α-Cadinol

Formula: C₁₅H₂₆O
Molecular weight: 222.3663
IUPAC Standard InChI: InChI=1S/C15H26O/c1-10(2)12-7-8-15(4,16)14-6-5-11(3)9-13(12)14/h9-10,12-14,16H,5-8H2,1-4H3/t12-,13?,14?,15+/m0/s1
IUPAC Standard InChIKey: LHYHMMRYTDARSZ-VXGQWTEUSA-N
CAS Registry Number: 481-34-5
Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript.
Stereoisomers:
Other names: (1R,4S,4aR,8aR)-4-Isopropyl-1,6-dimethyl-1,2,3,4,4a,7,8,8a-octahydronaphthalen-1-ol; 1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, (1R,4S,4aR,8aR)-; 1-Naphthalenol, 1,2,3,4,4a,7,8,8a-octahydro-1,6-dimethyl-4-(1-methylethyl)-, [1R-(1α,4β,4aβ,8aα)]-; Cadin-4-en-10-ol; (-)-α-Cadinol; l-α-Cadinol; (E)-α-Cadinol
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Information on this page:
Other data available:
- Mass spectrum (electron ionization)
- Gas Chromatography
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Normal alkane RI, non-polar column, temperature ramp

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	RTX-5 MS	RTX-1	HP-5 MS	RTX-1	HP-5 MS
Column length (m)	30.	60.	30.	60.	30.
Carrier gas	Helium	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.22	0.25	0.22	0.25
Phase thickness (μm)		0.25	0.25	0.25	0.25
T_start (C)	60.	60.	50.	60.	50.
T_end (C)	240.	230.	180.	230.	250.
Heat rate (K/min)	3.	2.	2.	2.	7.
Initial hold (min)					1.
Final hold (min)		5.		45.	5.
I	1663.	1643.	1654.	1632.	1639.
Reference	Pinheiro, de Queiros, et al., 2013	Bendiabdellah, El Amine Dib, et al., 2012	Phungpanya, Thongpoon, et al., 2012	Yapi, Boti, et al., 2012	Zouari, Ayadi, et al., 2012
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	HP-5 MS	HP-5 MS	DB-5	ZB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	Helium	Helium	Helium	Helium	Nitrogen
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	50.	60.	40.
T_end (C)	240.	220.	180.	240.	200.
Heat rate (K/min)	3.	4.	2.	3.	5.
Initial hold (min)		20.			5.
Final hold (min)		20.			5.
I	1654.	1640.	1649.	1653.	1656.
Reference	Bertoli, Lepnardi, et al., 2011	Feizbakhsh and Naeemy, 2011	Hammami, Kamoun, et al., 2011	Karimi, Farmani, et al., 2011	Vazquez, Demmel, et al., 2011
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	HP-5	HP-5	SPB-1	DB-5 MS
Column length (m)	30.	30.	30.	30.	60.
Carrier gas	Helium	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.252	0.32	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	50.	60.	60.	50.	40.
T_end (C)	300.	240.	240.	250.	250.
Heat rate (K/min)	50.	3.	3.	5.	5.
Initial hold (min)	5.		2.	3.	15.
Final hold (min)	5.			15.	15.
I	1655.	1652.	1653.	1651.	1635.
Reference	Bi Kouame, Bedi, et al., 2010	Cavar, Maksimovic, et al., 2010	Kahriman, Tosun, et al., 2010	Lazarevic, Palic, et al., 2010	Mesa-Arango, Betancur-Galvis, et al., 2010
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	BP-1	HP-5	HP-5	SPB-1	HP-5 MS
Column length (m)		30.	30.	30.	30.
Carrier gas	Nitrogen	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)		0.25	0.25	0.20	0.25
Phase thickness (μm)		0.25	0.25	0.20	0.25
T_start (C)	60.	40.	50.	70.	60.
T_end (C)	220.	260.	240.	220.	220.
Heat rate (K/min)	5.	4.	3.	3.	5.
Initial hold (min)	10.		5.		10.
Final hold (min)	30.	5.		15.
I	1646.	1661.	1650.	1624.	1656.
Reference	Mishra, Chaudhary, et al., 2010	Miyazawa, Kawauchi, et al., 2010	Monsef-Esfahani, Miri, et al., 2010	Neves, Rosa, et al., 2010	Ogunwande, Flamini, et al., 2010
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5 MS	HP-5 MS	HP-5	HP-5 MS	HP-5 MS
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	Helium	Helium	Hydrogen	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	100.	70.	70.	70.	60.
T_end (C)	220.	290.	290.	290.	220.
Heat rate (K/min)	2.	5.	5.	5.	6.
Initial hold (min)					3.
Final hold (min)		10.		10.
I	1652.	1666.	1664.	1648.	1642.
Reference	Pripdeevech, Chumpolsri, et al., 2010	Radulovic, Blagojevic, et al., 2010	Radulovic, Dordevic, et al., 2010	Radulovic, Dordevic, et al., 2010, 2	Safaei-Ghomi and Batooli, 2010
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	HP-5MS	OV-101	SE-54	DB-5
Column length (m)	30.	30.	50.	30.	30.
Carrier gas	Helium	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	50.	50.	70.	60.	50.
T_end (C)	220.	250.	220.	260.	250.
Heat rate (K/min)	4.	7.	2.	2.	5.
Initial hold (min)	2.	1.		5.	2.
Final hold (min)	2.	5.		999.
I	1648.	1669.	1643.	1657.	1654.
Reference	Xu, Tang, et al., 2010	Zouari, Zouari, et al., 2010	Benites, Moiteiro, et al., 2009	Dayisoylu and Alma, 2009	Ho, Wang, et al., 2009
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5 MS	HP-5	VF-1 MS	RTX-1	RTX-1
Column length (m)	30.	30.	30.	60.	60.
Carrier gas	Hydrogen	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.32	0.25	0.22	0.22
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	30.	50.	60.	60.	60.
T_end (C)	230.	280.	280.	230.	230.
Heat rate (K/min)	8.	5.	4.	2.	2.
Initial hold (min)	5.	2.	5.
Final hold (min)	10.	5.	10.	30.	30.
I	1674.	1653.	1645.	1637.	1643.
Reference	Karlsson, Birgersson, et al., 2009	Lago, Favero, et al., 2009	Marchesini, Prada, et al., 2009	Museli, Pau, et al., 2009	Museli, Pau, et al., 2009
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	BP-1	5 % Phenyl methyl siloxane	DB-5	HP-5 MS	HP-5 MS
Column length (m)	50.	60.	30.	30.	30.
Carrier gas	Helium	Helium	Nitrogen	Helium
Substrate
Column diameter (mm)	0.22	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25
T_start (C)	60.	90.	40.	50.	60.
T_end (C)	220.	225.	230.	280.	280.
Heat rate (K/min)	2.	3.	2.	4.	3.
Initial hold (min)
Final hold (min)	20.	3.
I	1644.	1653.	1654.	1659.	1654.
Reference	Ottavioli, Bighelli, et al., 2009	Retta, Gattuso, et al., 2009	Scrivanti, Anton, et al., 2009	Zhao, Zeng, et al., 2009	Baziou, Couladis, et al., 2008
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	HP-5 MS	DB-5	HP-5	SLB-5 MS
Column length (m)	25.	30.	30.	30.	30.
Carrier gas	Nitrogen	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.22	0.25	0.25	0.32	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	50.	50.	100.	100.	50.
T_end (C)	300.	230.	300.	240.	250.
Heat rate (K/min)	6.5	4.	20.	5.	3.
Initial hold (min)	2.	4.	2.	2.	2.
Final hold (min)	7.	10.	10.	5.	10.
I	1677.	1654.	1653.	1653.	1659.
Reference	Chieng, Assim, et al., 2008	Forero, Quijano, et al., 2008	Khokra, Prakash, et al., 2008	Lago, Romoff, et al., 2008	Lo Presti, Sciarrone, et al., 2008
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5 MS	RTX-1	Elite-1	HP-5 MS	HP-5
Column length (m)	30.	60.	30.	30.	30.
Carrier gas	Helium	He	Helium	Helium	Nitrogen
Substrate
Column diameter (mm)	0.25	0.22	0.32	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	50.	60.	60.	60.	50.
T_end (C)	300.	230.	246.	250.	280.
Heat rate (K/min)	5.	2.	3.	2.	5.
Initial hold (min)	5.			8.	1.
Final hold (min)	5.	35.		15.	1.
I	1650.	1643.	1649.	1651.	1648.
Reference	Noudogbessi, Yedomonhan, et al., 2008	Paolini, Tomi, et al., 2008	Raj, Baby, et al., 2008	Sahraoui, Vian, et al., 2008	Saidana, Mahjoub, et al., 2008
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5 MS	HP-5	HP-5	HP-5MS	DB-5
Column length (m)	30.	25.	30.	30.	30.
Carrier gas	Helium	Helium	Helium	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.26
Phase thickness (μm)	0.25	0.25	0.32	0.25	0.25
T_start (C)	50.	60.	60.	60.	60.
T_end (C)	240.	240.	250.	240.	240.
Heat rate (K/min)	3.	4.	5.	3.	3.
Initial hold (min)		2.	30.
Final hold (min)
I	1698.	1652.	1653.	1680.	1646.
Reference	Sarikurkcu, Tepe, et al., 2008	Verdian-rizi, 2008	Yassa and Akhani, 2008	Argyropoulou, Daferera, et al., 2007	Bos, Woerdenbag, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	RTX-5 MS	DB-5	HP-5MS	HP-5MS
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	N2	He	Helium	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.26	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	50.	60.	60.	60.	60.
T_end (C)	240.	200.	290.	250.	250.
Heat rate (K/min)	5.	2.	3.	2.	2.
Initial hold (min)	1.	2.		8.	8.
Final hold (min)	4.	10.		15.	15.
I	1653.	1648.	1646.	1651.	1657.
Reference	Cheraif, Ben Jannet, et al., 2007	Edris, Chizzola, et al., 2007	Elfami, Bos, et al., 2007	Ferhat, Meklati, et al., 2007	Ferhat, Tigrine-Kordjani, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Col-Elite 5MS	HP-1	DB-5	ZB-5	DB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	He		Helium
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	30.	60.	60.	60.	60.
T_end (C)	246.	240.	300.	220.	300.
Heat rate (K/min)	3.	2.	3.	4.	3.
Initial hold (min)				5.
Final hold (min)		20.		20.
I	1668.	1630.	1640.	1660.	1630.
Reference	Gudaityte and Venskutonis R.P., 2007	Hachicha, Skanji, et al., 2007	Limberger, Scopel, et al., 2007	Mohottalage, Tabacchi, et al., 2007	Moreno, Lima, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	HP-5	Methyl Silicone	HP-5 MS	SPB-1
Column length (m)	30.	25.	50.	25.	30.
Carrier gas	Helium	H2	Helium	Helium	He
Substrate
Column diameter (mm)	0.25	0.2	0.25	0.25	0.2
Phase thickness (μm)	0.25	0.33		0.25	0.2
T_start (C)	60.	60.	50.	100.	70.
T_end (C)	220.	240.	240.	280.	220.
Heat rate (K/min)	4.	3.	3.	4.	3.
Initial hold (min)				3.
Final hold (min)				5.	15.
I	1655.	1656.	1671.	1662.	1628.
Reference	Morteza-Semnani, Saeedi, et al., 2007	Oliveira, Leitão, et al., 2007	Ozcan and Chalchat, 2007	Phutdhawong, Kawaree, et al., 2007	Pinto, Salgueiro, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	DB-5	Elite-5MS	HP-5MS	HP-5 MS
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	Helium		He	He	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.32	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.5	0.25	0.25
T_start (C)	40.	40.	40.	60.	60.
T_end (C)	260.	210.	280.	280.	280.
Heat rate (K/min)	4.	2.	4.	3.	3.
Initial hold (min)			5.
Final hold (min)		33.	10.
I	1648.	1652.	1661.	1608.	1654.
Reference	Ristic, Krivokuca-Dokic, et al., 2007	Sylvestre, Longtin, et al., 2007	Tava, Pecetti, et al., 2007	Tzakou, Bazos, et al., 2007	Vagionas, Graikou, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5MS	HP-5	HP-5MS	DB-5	DB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.32	0.25	0.25	0.25
T_start (C)	40.	60.	40.	60.	60.
T_end (C)	250.	250.	260.	300.	300.
Heat rate (K/min)	3.	5.	4.	3.	3.
Initial hold (min)	5.	30.
Final hold (min)	10.
I	1651.	1653.	1653.7	1644.	1648.
Reference	Vichi, Riu-Aumatell, et al., 2007	Yassa and Akhani, 2007	Zizovic, Stamenic, et al., 2007	Apel, Sobral, et al., 2006	Apel, Sobral, et al., 2006, 2
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CP Sil 5 CB	BP-1	SPB-1	DB-1	DB-5
Column length (m)	25.	50.	30.	60.	30.
Carrier gas	He		Helium	Nitrogen
Substrate
Column diameter (mm)		0.22	0.20	0.25	0.32
Phase thickness (μm)		0.25	0.20		0.25
T_start (C)	80.	60.	70.	40.	60.
T_end (C)	270.	220.	220.	200.	230.
Heat rate (K/min)	10.	2.	3.	2.	3.
Initial hold (min)				1.
Final hold (min)		20.	15.	9.	15.
I	1663.	1638.	1628.	1637.	1653.
Reference	Ayoub, Al-Azizi, et al., 2006	Boti, Yao, et al., 2006	Cavaleiro, Pinto, et al., 2006	Chen, Sheu, et al., 2006	Damjanovic, Skala, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5MS	DB-5	HP-1	HP-5	DB-5
Column length (m)	30.	30.	50.	30.	30.
Carrier gas		Helium	He	He
Substrate
Column diameter (mm)	0.25	0.26	0.2	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.33	0.25	0.25
T_start (C)	60.	60.	60.	50.	40.
T_end (C)	280.	290.	250.	300.	210.
Heat rate (K/min)	4.	3.	2.	5.	2.
Initial hold (min)				5.	2.
Final hold (min)			60.	5.	33.
I	1651.	1646.	1635.	1656.	1652.
Reference	Ebrahim Sajjadi and Mehregan, 2006	Elfami, Komar, et al., 2006	Fernandez, Pintaric, et al., 2006	Figuérédo, Cabassu, et al., 2006	Garneau F.X., Collin G., et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	HP-5	RTX-1	BP-1	CP Sil 5 CB
Column length (m)	30.	30.	30.	50.	30.
Carrier gas	Helium	Helium	He	He	N2
Substrate
Column diameter (mm)	0.25	0.32	0.32	0.22	0.32
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	60.	60.	50.
T_end (C)	260.	260.	300.	220.	300.
Heat rate (K/min)	3.	5.	4.	2.	4.
Initial hold (min)		2.
Final hold (min)		13.		20.
I	1653.	1657.	1643.	1641.	1636.
Reference	Javidnia, Miri, et al., 2006	Kucuk, Gulec, et al., 2006	Kula, Izydorczyk, et al., 2006	Lesueur, Ban, et al., 2006	Lis and Milczarek, 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-5	CP-Sil 5 CB	NB-30	DB-5
Column length (m)	30.	30.	25.	30.	25.
Carrier gas	He	He	Hydrogen	He	N2
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.2	0.25
Phase thickness (μm)	0.25	0.25	0.15	0.25	0.15
T_start (C)	60.	60.	50.	50.	50.
T_end (C)	220.	220.	230.	250.	200.
Heat rate (K/min)	4.	4.	3.	2.	4.
Initial hold (min)		5.			3.
Final hold (min)
I	1656.	1656.	1643.	1644.	1643.
Reference	Morteza-Semnani, Akbarzadeh, et al., 2006	Morteza-Semnani K., Saeedi M., et al., 2006	Olawore, Usman, et al., 2006	Orav, Raal, et al., 2006	Ouamba, Ouabonzi, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-5	HP-5	HP-5	DB-5
Column length (m)	30.	30.	30.	25.	30.
Carrier gas	Hydrogen	Hydrogen	H2	H2	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.32	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	70.	70.	50.	60.	60.
T_end (C)	280.	280.	280.	240.	200.
Heat rate (K/min)	4.	4.	4.	3.	2.
Initial hold (min)	4.	4.	2.
Final hold (min)			10.		60.
I	1653.	1652.	1653.	1658.	1653.
Reference	Pino, Marbot, et al., 2006	Pino, Marbot, et al., 2006	Pino, Sauri-Duch, et al., 2006	Potzernheim, Bizzo, et al., 2006	Rout, Naik, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	HP-5MS	DB-1	CP Sil 5 CB	Methyl Silicone
Column length (m)	30.	30.	60.	25.	25.
Carrier gas	He	He	Helium		N2
Substrate
Column diameter (mm)	0.25	0.32	0.25	0.25	0.3
Phase thickness (μm)	0.25	0.25	0.25		0.15
T_start (C)	60.	60.	60.	50.	50.
T_end (C)	260.	243.	250.	230.	210.
Heat rate (K/min)	5.	3.	5.	3.	2.
Initial hold (min)					5.
Final hold (min)			10.
I	1670.	1651.	1610.	1644.	1674.
Reference	Sabulal, Dan, et al., 2006	Sabulal, Dan, et al., 2006, 2	Sonboli, Mirjalili, et al., 2006	Tesso, Kubeczka, et al., 2006	Tonzibo, Coffy, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	SPB-1	SPB-1	DB-5MS	DB-5
Column length (m)	50.	50.	30.	30.	25.
Carrier gas	N2	He	He	He
Substrate
Column diameter (mm)	0.25	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.33	0.25	0.25	0.15
T_start (C)	90.	50.	50.	60.	40.
T_end (C)	240.	220.	250.	240.	220.
Heat rate (K/min)	4.	4.	4.	3.	3.
Initial hold (min)		1.	1.		5.
Final hold (min)		10.	10.
I	1650.	1622.	1619.	1654.	1655.
Reference	Velasco-Negueruela, Pérez-Alonso, et al., 2006	Wong, Lim, et al., 2006	Wong, Sivasothy, et al., 2006	Busman, Zoghbi, et al., 2005	Chagonda and Chalchat, 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-5	HP-5	CP Sil 8 CB	DB-1
Column length (m)	30.	30.	25.	30.	60.
Carrier gas	He	He	He	He	N2
Substrate
Column diameter (mm)	0.25	0.25	0.2	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.33	0.25	0.25
T_start (C)	60.	60.	60.	80.	60.
T_end (C)	240.	240.	240.	200.	250.
Heat rate (K/min)	3.	3.	3.	3.	5.
Initial hold (min)				5.
Final hold (min)			7.	5.	10.
I	1653.	1650.	1651.	1656.	1654.
Reference	Chaverri and Cicció, 2005	Chaverri and Cicció, 2005	Duarte, Figueira, et al., 2005	Facey, Porter, et al., 2005	Fakhari A.R., Sonboli A., et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	HP-5	HP-5	HP-5MS	DB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	50.	60.	35.
T_end (C)	300.	30.	300.	200.	280.
Heat rate (K/min)	3.	4.	5.	4.	4.
Initial hold (min)	3.	3.	5.	30.	2.
Final hold (min)		15.	5.
I	1654.	1655.	1656.	1650.	1661.
Reference	Ferraz, Limberger, et al., 2005	Ferretti, Maggi, et al., 2005	Figuérédo, Cabassu, et al., 2005	Gauvin and Smadja, 2005	Kowalski and Wolski, 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-5	DB-5	CP Sil 5 CB	HP-5
Column length (m)	30.	30.	30.	25.	30.
Carrier gas	He	He	He		He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.15	0.25
T_start (C)	60.	60.	60.	50.	70.
T_end (C)	230.	220.	220.	230.	240.
Heat rate (K/min)	3.	4.	4.	3.	5.
Initial hold (min)		5.	4.
Final hold (min)
I	1647.	1654.	1655.	1643.	1654.
Reference	Limberger, Sobral, et al., 2005	Morteza-Semnani, Akbarzadeh, et al., 2005	Morteza-Semnani and Saeedi, 2005	Olawore, Ogunwande, et al., 2005	Oyedeji, Yani, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	HP-5MS	HP-5MS	DB-1	DB-5
Column length (m)	50.	30.	30.	30.	30.
Carrier gas	N2		He	He	He
Substrate
Column diameter (mm)	0.25	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.25		0.25	0.25
T_start (C)	95.	60.	60.	50.	40.
T_end (C)	240.	280.	280.	265.	240.
Heat rate (K/min)	4.	3.	4.	2.5	4.
Initial hold (min)				1.
Final hold (min)				20.
I	1651.	1655.	1654.	1617.	1651.
Reference	Pala-Paul, Perez-Alonso, et al., 2005	Petrakis, Roussis, et al., 2005	Sajjadi S.E. and Eskandari B., 2005	Sarkhail, Amin, et al., 2005	Sefidkon and Jamzad, 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	HP-5MS	DB-5	DB-5	DB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	40.	60.	60.	60.	60.
T_end (C)	260.	280.	300.	300.	300.
Heat rate (K/min)	2.	3.	3.	3.	3.
Initial hold (min)	5.	5.
Final hold (min)	20.
I	1655.	1652.	1649.	1649.	1650.
Reference	Senatore, Apostolides Arnold, et al., 2005	Setzer, Noletto, et al., 2005	Simoes-Pires C.A., Debenedetti S., et al., 2005	Simoes-Pires C.A., Debenedetti S., et al., 2005	Simoes-Pires C.A., Debenedetti S., et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	PE-5	HP-5MS	RTX-1	DB-1	BP-1
Column length (m)	30.	30.	60.	60.	30.
Carrier gas	H2	He	He	He	N2
Substrate
Column diameter (mm)	0.32	0.25	0.25	0.25	0.32
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	60.	60.	60.
T_end (C)	230.	280.	25.	250.	220.
Heat rate (K/min)	5.	3.	5.	5.	5.
Initial hold (min)	2.
Final hold (min)	4.		10.	10.	15.
I	1648.	1658.	1635.	1632.	1656.
Reference	Singh, Raina, et al., 2005	Slavkovska, Couladis, et al., 2005	Sonboli, Salehi, et al., 2005	Sonboli, Salehi, et al., 2005, 2	Srivastava, Srivastava, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	CP Sil 8 CB	RTX-5	HP-5MS	DB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas		He		He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.32
Phase thickness (μm)	0.25		0.25	0.25	0.25
T_start (C)	40.	60.	60.	60.	60.
T_end (C)	210.	290.	220.	280.	280.
Heat rate (K/min)	2.	3.	3.	3.	3.
Initial hold (min)	2.	5.
Final hold (min)	33.
I	1659.	1648.	1653.	1617.	1628.
Reference	Stevanovic, Garneau, et al., 2005	Suárez, Vásquez, et al., 2005	Szafranek, Chrapkowska, et al., 2005	Tzakou, Bazos, et al., 2005	Tzakou and Constantinidis, 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5 MS	DB-1	DB-1	HP-5MS	CP Sil 5 CB
Column length (m)	30.	50.	50.	30.	30.
Carrier gas	Helium	N2			N2
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	90.	60.	40.	50.
T_end (C)	240.	240.	240.	220.	200.
Heat rate (K/min)	3.	4.	3.	3.	5.
Initial hold (min)				5.
Final hold (min)				10.
I	1654.	1648.	1626.	1651.	1648.
Reference	Urdampilleta, Amat, et al., 2005	Velasco-Negueruela, Pérez-Alonso, et al., 2005	Velasco-Negueruela, Pérez-Alonso, et al., 2005, 2	Vichi, Riu-Aumatell, et al., 2005	Agnaniet, Menut, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	BP-1	DB-1	DB-5	DB-5	RTX-1
Column length (m)	50.	30.	30.	60.	30.
Carrier gas		N2	N2	He	N2
Substrate
Column diameter (mm)	0.22	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	50.	40.	40.	60.
T_end (C)	220.	200.	230.	280.	300.
Heat rate (K/min)	2.	5.	2.	4.	4.
Initial hold (min)				4.
Final hold (min)	20.
I	1640.	1637.	1653.	1659.	1642.
Reference	Blanc, Muselli, et al., 2004	Fekam Boyom, Fotio, et al., 2004	González, Guerra, et al., 2004	Kalvandi, Sefidkon, et al., 2004	Kalemba and Thiem, 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-5	DB-5	HP-5MS	HP-5MS
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He		He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	40.	60.	60.
T_end (C)	300.	300.	210.	280.	280.
Heat rate (K/min)	3.	3.	2.	3.	3.
Initial hold (min)			2.
Final hold (min)			33.
I	1662.	1646.	1653.	1651.	1651.
Reference	Lago, de Ávila, et al., 2004	Limberger, Sobral, et al., 2004	Lopez Arze, Collin, et al., 2004	Malencic, Couladis, et al., 2004	Malencic, Couladis, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	BP-1	HP-5MS	NB-30	NB-30	DB-1
Column length (m)	25.	30.	50.	50.	50.
Carrier gas	N2	He	He	He	N2
Substrate
Column diameter (mm)	0.25	0.25	0.2	0.2	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	50.	50.	95.
T_end (C)	220.	275.	250.	250.	240.
Heat rate (K/min)	5.	4.	2.	2.	4.
Initial hold (min)
Final hold (min)
I	1645.	1662.	1644.	1643.	1630.
Reference	Mallavarapu, Kulkarni, et al., 2004	Mehrabani, Asadipour, et al., 2004	Orav, Stulova, et al., 2004	Orav, Stulova, et al., 2004	Palá-Paúl, Velasco-Negueruela, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	NB-30	DB-5	Methyl Silicone	HP-5 MS	HP-5MS
Column length (m)	50.	30.	60.	30.	30.
Carrier gas	He	He	He	Helium	He
Substrate
Column diameter (mm)	0.20	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	50.	35.	60.	60.	60.
T_end (C)	250.	220.	200.	200.	280.
Heat rate (K/min)	2.	2.5	4.	4.	3.
Initial hold (min)			1.	1.
Final hold (min)		6.	20.	20.
I	1644.	1654.	1650.	1650.	1655.
Reference	Raal, Paaver, et al., 2004	Rohloff, Mordal, et al., 2004	Rojas, Usubillaga, et al., 2004	Royas, Usubillaga, et al., 2004	Couladis, Özcan, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	RTX-5Sil	HP-5MS	HP-1	DB-1	HP-5MS
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	He	N2	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	70.	60.	70.	50.	60.
T_end (C)	200.	220.	200.	200.	275.
Heat rate (K/min)	4.	5.	10.	5.	4.
Initial hold (min)		20.
Final hold (min)	10.	20.
I	1629.	1660.	1637.	1638.	1657.
Reference	Dudai, Larkov, et al., 2003	Feizbaksh, Saber Tehrani, et al., 2003	Fekam Boyom, Amvam Zollo, et al., 2003	Fekam Boyom, Ngouana, et al., 2003	Ghannadi, Aghazari, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Methyl Silicone	RSL-200	RSL-200	DB-5	DB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	H2	H2	He	He
Substrate
Column diameter (mm)	0.32	0.32	0.32	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	40.	40.	60.	60.
T_end (C)	250.	280.	280.	250.	280.
Heat rate (K/min)	2.	6.	6.	3.	3.
Initial hold (min)	2.	5.	5.
Final hold (min)	5.	5.	5.		30.
I	1638.	1647.	1641.	1649.	1636.
Reference	Jayaprakasha, Rao, et al., 2003	Jirovetz, Buchbauer, et al., 2003	Jirovetz, Buchbauer, et al., 2003, 2	Limberger, Simões-Pires, et al., 2003	Marongiu, Porcedda, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-5	DB-5	HP-5	HP-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	H2	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	60.	60.	60.
T_end (C)	280.	280.	280.	280.	280.
Heat rate (K/min)	3.	3.	4.	3.	4.
Initial hold (min)			10.
Final hold (min)	30.	30.	40.
I	1642.	1643.	1653.	1635.	1650.
Reference	Marongiu, Porcedda, et al., 2003	Marongiu, Porcedda, et al., 2003	Pino, Marbot, et al., 2003	Pitarokili, Tzakou, et al., 2003	Sajjadi and Mehregan, 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	DB-5	DB-1	DB-5	HP-5
Column length (m)	30.	30.	60.	30.	60.
Carrier gas	He		He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	40.	50.	60.	40.
T_end (C)	280.	260.	280.	240.	250.
Heat rate (K/min)	4.	2.	4.	3.	5.
Initial hold (min)		5.			15.
Final hold (min)
I	1649.	1653.	1634.	1657.	1653.
Reference	Sajjadi and Mehregan, 2003, 2	Senatore and Bruno, 2003	Shahmir, Ahmadi, et al., 2003	da Silva, Luz, et al., 2003	Stashenko, Jaramillo, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	DB-5	DB-1	OV-101	HP-1
Column length (m)	60.	30.	60.	25.	30.
Carrier gas		He	He		He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.32	0.25
Phase thickness (μm)	0.25	0.25	0.25		0.25
T_start (C)	40.	60.	50.	50.	70.
T_end (C)	250.	240.	280.	200.	220.
Heat rate (K/min)	5.	3.	4.	5.	3.
Initial hold (min)	15.
Final hold (min)					15.
I	1654.	1654.	1634.	1638.	1627.
Reference	Stashenko, Jaramillo, et al., 2003	Zoghbi, Andrade, et al., 2003	Ahmadi, Mirza, et al., 2002	Boyom, Keumedjio, et al., 2002	Cavaleiro, Salgueiro, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	5 % Phenyl methyl siloxane	DB-5	PTE-5	SE-30	RSL-200
Column length (m)	30.	30.	60.	50.	30.
Carrier gas	He	He	H2	He	H2
Substrate
Column diameter (mm)	0.25	0.25	0.32	0.25	0.32
Phase thickness (μm)	0.25	0.25	0.30	0.25	0.25
T_start (C)	75.	60.	60.	70.	40.
T_end (C)	200.	240.	285.	240.	280.
Heat rate (K/min)	3.	3.	4.3	4.	6.
Initial hold (min)	4.				5.
Final hold (min)	8.				5.
I	1654.	1656.	1653.	1644.	1676.
Reference	Cicció and Gómez-Laurito, 2002	Flamini, Ertugrul, et al., 2002	Gudzic, Djokovic, et al., 2002	Iñigo, Palá-Paúl, et al., 2002	Jirovetz, Buchbauer, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CP Sil 8 CB	DB-5	DB-1	DB-5	DB-5
Column length (m)	30.	30.	25.	30.	30.
Carrier gas	He		He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.23	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.20	0.25	0.25
T_start (C)	50.	40.	50.	60.	35.
T_end (C)	220.	210.	200.	240.	280.
Heat rate (K/min)	3.	2.	3.	3.	3.
Initial hold (min)	2.	2.	3.		2.
Final hold (min)		33.	30.		15.
I	1640.	1658.	1642.	1653.	1665.
Reference	Juteau, Masotti, et al., 2002	Kabouss, Charrouf, et al., 2002	Khallouki, Younos, et al., 2002	Kobaisy, Tellez, et al., 2002	Krauze-Baranowska, Mardarowicz, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	OV-101	DB-5	HP-5	DB-5
Column length (m)	30.	25.	30.	30.	30.
Carrier gas	He	He	He		He
Substrate
Column diameter (mm)	0.25	0.32	0.25	0.25	0.25
Phase thickness (μm)	0.25		0.25	0.25	0.25
T_start (C)	35.	50.	60.	60.	60.
T_end (C)	280.	200.	250.	275.	240.
Heat rate (K/min)	4.	5.	3.	4.	3.
Initial hold (min)	2.			4.
Final hold (min)	15.
I	1667.	1627.	1647.	1652.	1654.
Reference	Krauze-Baranowska, Mardarowicz, et al., 2002, 2	Kuiate, Bessière, et al., 2002	Limberger, Simões-Pires, et al., 2002	Lockwood, Asghari, et al., 2002	Maia, da Silva, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5MS	OV-101	DB-5	DB-1	SPB-5
Column length (m)	30.	25.	30.	30.	30.
Carrier gas	He	He	He	He	Helium
Substrate
Column diameter (mm)	0.25	0.32	0.25	0.25	0.25
Phase thickness (μm)	0.25		0.25	0.25	0.25
T_start (C)	60.	50.	60.	60.	60.
T_end (C)	240.	200.	220.	250.	250.
Heat rate (K/min)	3.	5.	4.	4.	4.
Initial hold (min)			5.	10.	2.
Final hold (min)					20.
I	1652.	1647.	1654.	1670.	1653.
Reference	Maia, Zoghbi, et al., 2002	Menut, Bessière, et al., 2002	Morteza-Semnani, Saeedi, et al., 2002	Norouzi-Arasi, Yavari, et al., 2002	Pino, Marbot, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-1	DB-1	DB-5MS	DB-5
Column length (m)	25.	60.	50.	30.	30.
Carrier gas	He	He	N2	He	He
Substrate
Column diameter (mm)	0.2	0.25	0.25	0.25	0.25
Phase thickness (μm)			0.25	0.25	0.25
T_start (C)	60.	40.	60.	60.	60.
T_end (C)	220.	250.	240.	270.	240.
Heat rate (K/min)	3.	4.	3.	3.	3.
Initial hold (min)
Final hold (min)
I	1642.	1629.	1626.	1655.	1655.
Reference	Schwob, Bessière, et al., 2002	Sefidkon, Dabiri, et al., 2002	Velasco-Negueruela, Pérez-Alonso, et al., 2002	Zoghbi, Andrade, et al., 2002	Zoghbi, Andrade, et al., 2002, 2
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5MS	Optima-5	RTX-1	DB-5MS	DB-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	N2	He	He
Substrate
Column diameter (mm)	0.25	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.25		0.25	0.25	0.25
T_start (C)	60.	50.	60.	60.	60.
T_end (C)	240.	250.	300.	240.	270.
Heat rate (K/min)	3.	3.	4.	3.	3.
Initial hold (min)		3.
Final hold (min)				30.
I	1637.	1663.	1644.	1631.	1654.
Reference	Cherchi, Deidda, et al., 2001	Jacquemond-Collet, Bessière, et al., 2001	Kalemba, Marschall, et al., 2001	Marongiu, Porcedda, et al., 2001	Palmeira, Conserva, et al., 2001
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	DB-1	DB-1	HP-5	HP-5
Column length (m)	30.	30.	60.	30.	30.
Carrier gas	N2	He	N2	H2	He
Substrate
Column diameter (mm)	0.25	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.25		0.25	0.25	0.25
T_start (C)	80.	60.	60.	40.	40.
T_end (C)	225.	240.	220.	280.	240.
Heat rate (K/min)	4.	3.	3.	3.	3.
Initial hold (min)			5.	10.	5.
Final hold (min)			22.	10.
I	1620.	1661.0	1651.	1656.	1649.
Reference	Palá-Paúl, Pérez-Alonso, et al., 2001	Santos, Moreira, et al., 2001	Bailac, Dellacasa, et al., 2000	Bicalho, Pereira, et al., 2000	Novak, Novak, et al., 2000
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	OV-101	RTX-1	OV-101	OV-101
Column length (m)	30.	25.	30.	25.	50.
Carrier gas	He	N2	N2		N2
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.32	0.2
Phase thickness (μm)	0.25		0.25
T_start (C)	60.	50.	60.	50.	80.
T_end (C)	240.	200.	300.	200.	200.
Heat rate (K/min)	3.	5.	4.	5.	1.
Initial hold (min)
Final hold (min)					20.
I	1653.	1648.	1651.	1627.	1648.
Reference	Tellez, Dayan, et al., 2000	Ayedoun, Adéoti, et al., 1999	Kalemba, 1999	Kuiate, Zollo, et al., 1999	Menon, Chacko, et al., 1999
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CP Sil 5 CB	DB-5	DB-5	DB-5	OV-1
Column length (m)	25.	30.	30.	30.	50.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.32
Phase thickness (μm)	0.39	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	60.	60.	50.
T_end (C)	220.	240.	240.	240.	250.
Heat rate (K/min)	5.	3.	3.	3.	10.
Initial hold (min)	5.				5.
Final hold (min)	20.				20.
I	1643.	1652.	1652.	1653.	1669.
Reference	Rustaiyan, Masoudi, et al., 1999	Tellez, Canel, et al., 1999	Zoghbi, Andrade, et al., 1999	El-Sakhawy, El-Tantawy, et al., 1998	Kökdil, Kurucu, et al., 1998
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	DB-5	HP-1	OV-101	DB-1
Column length (m)	30.	30.	60.	25.
Carrier gas	He	Helium	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.32
Phase thickness (μm)	0.25	0.25	0.25
T_start (C)	60.	60.	50.	50.	80.
T_end (C)	240.	240.	280.	200.	220.
Heat rate (K/min)	3.	3.	4.	5.	6.
Initial hold (min)			5.
Final hold (min)
I	1651.	1658.	1631.	1648.	1626.
Reference	Maia, Zohhbi, et al., 1998	Santos, Andrade, et al., 1998	Stashenko, Cervantes, et al., 1998	Zollo, Biyiti, et al., 1998	Salgueiro, Vila, et al., 1997
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	CBP-1	OV-101	BP-1	HP-1
Column length (m)	30.	25.	50.	25.	25.
Carrier gas	He	He	He	N2	Helium
Substrate
Column diameter (mm)	0.25	0.22	0.25	0.50	0.32
Phase thickness (μm)					0.25
T_start (C)	60.	60.	50.	60.	60.
T_end (C)	240.	240.	250.	220.	220.
Heat rate (K/min)	4.	5.	2.	5.	4.
Initial hold (min)					2.
Final hold (min)					20.
I	1654.	1639.	1634.	1644.	1632.
Reference	Zunino, Novillo-Newton, et al., 1997	Zygadlo, Ariza-Espinar, et al., 1997	Orav, Kailas, et al., 1996	Rajeswara, Kaul, et al., 1996	Thanh, Dung, et al., 1996
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary
Active phase	Methyl Silicone	Methyl Silicone	CP Sil 8 CB
Column length (m)	50.	50.	25.
Carrier gas	N2	N2
Substrate
Column diameter (mm)	0.25	0.25	0.20
Phase thickness (μm)	0.17	0.17
T_start (C)	80.	80.	60.
T_end (C)	200.	200.	230.
Heat rate (K/min)	3.	3.	3.
Initial hold (min)			10.
Final hold (min)
I	1632.	1639.	1657.
Reference	Gopalakrishnan, Menon, et al., 1993	Gopalakrishnan, Menon, et al., 1993	Jantan and Goh, 1990
Comment	MSDC-RI	MSDC-RI	MSDC-RI

References

Go To: Top, Normal alkane RI, non-polar column, temperature ramp, Notes

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Forero, Quijano, et al., 2008
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Khokra, Prakash, et al., 2008
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Lo Presti, Sciarrone, et al., 2008
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Noudogbessi, Yedomonhan, et al., 2008
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Paolini, Tomi, et al., 2008
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Raj, Baby, et al., 2008
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Sahraoui, Vian, et al., 2008
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Kuiate, Bessière, et al., 2002
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Limberger, Simões-Pires, et al., 2002
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Lockwood, Asghari, et al., 2002
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Maia, da Silva, et al., 2002
Maia, J.G.S.; da Silva, M.H.L.; Andrade, E.H.A.; Zoghbi, M.G.B.; Carreira, L.M.M., Essential oils from Astronium urundeuva (Allemao) Engl. and A. fraxinifolium Schott ex Spreng., Flavour Fragr. J., 2002, 17, 1, 72-74, https://doi.org/10.1002/ffj.1046 . [all data]

Maia, Zoghbi, et al., 2002
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Menut, Bessière, et al., 2002
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Morteza-Semnani, Saeedi, et al., 2002
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Pino, Marbot, et al., 2002
Pino, J.A.; Marbot, R.; Vazquez, C., Characterization of volatiles in Loquat fruit (Eriobotrya japonica Lindl.), Revista CENIC Ciencias Quimicas, 2002, 33, 3, 115-119. [all data]

Schwob, Bessière, et al., 2002
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Sefidkon, Dabiri, et al., 2002
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Velasco-Negueruela, Pérez-Alonso, et al., 2002
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Zoghbi, Andrade, et al., 2002
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Zoghbi, Andrade, et al., 2002, 2
Zoghbi, M.G.B.; Andrade, E.H.A.; da Silva, M.H.; Maia, J.G.S.; Luz, A.I.R.; da Silva, J.D., Chemical variation in the essential oils of Hyptis crenata Pohl ex Benth., Flavour Fragr. J., 2002, 17, 1, 5-8, https://doi.org/10.1002/ffj.1031 . [all data]

Cherchi, Deidda, et al., 2001
Cherchi, G.; Deidda, D.; de Gioannis, B.; Marongiu, B.; Pompei, R.; Porcedda, S., Extraction of Santolina insularis essential oil by supercritical carbon dioxide: influence of some process parameters and biological activity, Flavour Fragr. J., 2001, 16, 1, 35-43, https://doi.org/10.1002/1099-1026(200101/02)16:1<35::AID-FFJ942>3.0.CO;2-Y . [all data]

Jacquemond-Collet, Bessière, et al., 2001
Jacquemond-Collet, I.; Bessière, J.-M.; Hannedouche, S.; Bertrand, C.; Fourasté, I.; Moulis, C., Identification of the alkaloids of Galipea officinalis by gas chromatography-mass spectrometry, Phytochem. Anal., 2001, 12, 5, 312-319, https://doi.org/10.1002/pca.594 . [all data]

Kalemba, Marschall, et al., 2001
Kalemba, D.; Marschall, H.; Bradesi, P., Constituents of the essential oil of Solidago gigantea Ait. (giant goldenrod), Flavour Fragr. J., 2001, 16, 1, 19-26, https://doi.org/10.1002/1099-1026(200101/02)16:1<19::AID-FFJ940>3.0.CO;2-U . [all data]

Marongiu, Porcedda, et al., 2001
Marongiu, B.; Porcedda, S.; Porta, G.D.; Reverchon, E., Extraction and isolation of Salvia desoleana and Mentha spicata subsp. insularis essential oils by supercritical CO₂, Flavour Fragr. J., 2001, 16, 5, 384-388, https://doi.org/10.1002/ffj.1021 . [all data]

Palmeira, Conserva, et al., 2001
Palmeira, S.F., Jr.; Conserva, L.M.; Andrade, E.H.A.; Guilhon, G.M.S.P., Analysis by GC-MS of the hexane extract of the aerial parts of Aristolochia acutifolia Duchtr., Flavour Fragr. J., 2001, 16, 2, 85-88, https://doi.org/10.1002/1099-1026(200103/04)16:2<85::AID-FFJ948>3.0.CO;2-2 . [all data]

Palá-Paúl, Pérez-Alonso, et al., 2001
Palá-Paúl, J.; Pérez-Alonso, M.J.; Velasco-Negueruela, A.; Palá-Paúl, R.; Sanz, J.; Conejero, Fco., Seasonal variation in chemical constituents of Santolina rosmarinifolia L. ssp. rosmarinifolia, Biochem. Syst. Ecol., 2001, 29, 7, 663-672, https://doi.org/10.1016/S0305-1978(01)00032-1 . [all data]

Santos, Moreira, et al., 2001
Santos, P.R.; Moreira, D.L.; Guimaraes, E.F.; Kaplan, M.A.C., Essential oil analysis of 10 piperaceae species from the Brazilian Atlantic forest, Phytochemistry, 2001, 58, 4, 547-551, https://doi.org/10.1016/S0031-9422(01)00290-4 . [all data]

Bailac, Dellacasa, et al., 2000
Bailac, P.N.; Dellacasa, A.D.; Bernasconi, H.O.; Firpo, N.H.; Ponzi, M.I., Composicion del aceite esencial y actividad antimicrobiana de eupatorium patens, Bol. Soc. Chil. Quim., 2000, 45, 207-211. [all data]

Bicalho, Pereira, et al., 2000
Bicalho, B.; Pereira, A.S.; Aquino Neto, F.R.; Pinto, A.C.; Rezende, C.M., Application of high-temperature gas chromatography-mass spectrometry to the investigation of glycosidically bound components related to cashew applie (Anacardium occidentale L. Var. nanum) volatiles, J. Agric. Food Chem., 2000, 48, 4, 1167-1174, https://doi.org/10.1021/jf9909252 . [all data]

Novak, Novak, et al., 2000
Novak, J.; Novak, S.; Bitsch, C.; Franz, C.M., Essential oil composition of underground parts of Valeriana celtica ssp. from Austria and Italy, Flavour Fragr. J., 2000, 15, 1, 40-42, https://doi.org/10.1002/(SICI)1099-1026(200001/02)15:1<40::AID-FFJ863>3.0.CO;2-B . [all data]

Tellez, Dayan, et al., 2000
Tellez, M.R.; Dayan, F.E.; Schrader, K.K.; Wedge, D.E.; Duke, S.O., Composition and some biological activities of the essential oils of Callicarpa Americana (L.), J. Agric. Food Chem., 2000, 48, 7, 3008-3012, https://doi.org/10.1021/jf991026g . [all data]

Ayedoun, Adéoti, et al., 1999
Ayedoun, M.A.; Adéoti, B.S.; Setondji, J.; Tchoumbougnang, F.; Kuiaté, J.R.; Zollo, P.H.A.; Menut, C.; Lamaty, G.; Bessière, J.M., Aromatic plants of tropical West Africa. XII. Essential oil of Hoslundia opposita Vahl. growing in Benin and Cameroon, Flavour Fragr. J., 1999, 14, 5, 319-321, https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<319::AID-FFJ836>3.0.CO;2-O . [all data]

Kalemba, 1999
Kalemba, D., Constituents of the essential oil of Artemisia asiatica Nakai, Flavour Fragr. J., 1999, 14, 3, 173-176, https://doi.org/10.1002/(SICI)1099-1026(199905/06)14:3<173::AID-FFJ805>3.0.CO;2-Q . [all data]

Kuiate, Zollo, et al., 1999
Kuiate, J.-R.; Zollo, P.-H.A.; Nguefa, E.H.; Bessière, J.-M.; Lamaty, G.; Menut, C., Composition of the essential oils from the leaves of Microglossa pyrifolia (Lam.) O. Kuntze and Helichrysum odoratissimum (L.) Less. growing in Cameroon, Flavour Fragr. J., 1999, 14, 2, 82-84, https://doi.org/10.1002/(SICI)1099-1026(199903/04)14:2<82::AID-FFJ780>3.0.CO;2-Z . [all data]

Menon, Chacko, et al., 1999
Menon, A.N.; Chacko, S.; Narayanan, C.S., Free and glycosidically bound volatiles of cardamom (Eletteria cardamomum Maton var. miniscula Burkill), Flavour Fragr. J., 1999, 14, 1, 65-68, https://doi.org/10.1002/(SICI)1099-1026(199901/02)14:1<65::AID-FFJ789>3.0.CO;2-A . [all data]

Rustaiyan, Masoudi, et al., 1999
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Tellez, Canel, et al., 1999
Tellez, M.R.; Canel, C.; Rimando, A.M.; Duke, S.O., Differential accumulation of isoprenoids in glanded and glandless Artemisia annua L, Phytochemistry, 1999, 52, 6, 1035-1040, https://doi.org/10.1016/S0031-9422(99)00308-8 . [all data]

Zoghbi, Andrade, et al., 1999
Zoghbi, M.G.B.; Andrade, E.H.A.; Maia, J.G.S., The essential oil of Vitex angus-castus L. growing in the Amazon region, Flavour Fragr. J., 1999, 14, 4, 211-213, https://doi.org/10.1002/(SICI)1099-1026(199907/08)14:4<211::AID-FFJ812>3.0.CO;2-W . [all data]

El-Sakhawy, El-Tantawy, et al., 1998
El-Sakhawy, F.S.; El-Tantawy, M.E.; Ross, S.A.; El-Sohly, M.A., Composition and antimicrobial activity of the essential oil of Murraya exotica L., Flavour Fragr. J., 1998, 13, 1, 59-62, https://doi.org/10.1002/(SICI)1099-1026(199801/02)13:1<59::AID-FFJ693>3.0.CO;2-L . [all data]

Kökdil, Kurucu, et al., 1998
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Maia, Zohhbi, et al., 1998
Maia, J.G.S.; Zohhbi, M.G.B.; Andrade, E.H.A.; Santos, A.S.; da Silva, M.H.L.; Luz, A.I.R.; Bastos, C.N., Constituents of the essential oil of Piper aduncum L. growing wild in the Amazon region, Flavour Fragr. J., 1998, 13, 4, 269-272, https://doi.org/10.1002/(SICI)1099-1026(1998070)13:4<269::AID-FFJ744>3.0.CO;2-A . [all data]

Santos, Andrade, et al., 1998
Santos, A.S.; Andrade, E.H.A.; Zoghbi, M. das.G.B.; Luz, A.I.R.; Maia, J.G.S., Sesquiterpenes of Amazonian Piper species, Acta Amazomica, 1998, 28, 2, 127-130. [all data]

Stashenko, Cervantes, et al., 1998
Stashenko, E.E.; Cervantes, M.; Combariza, Y.; Martínez, J.R., HRGC-FID-MSD Analysis of the Secondary Metabolites Obtained by Different Extraction Methods from Lepechinia schiedeana, and Evaluation of its Antioxidant Activity in vitro in 20th International Symposium on Capillary Chromatography, 1998, 1-11. [all data]

Zollo, Biyiti, et al., 1998
Zollo, P.H.A.; Biyiti, L.; Tchoumbougnang, F.; Menut, C.; Lamaty, G.; Bouchet, Ph., Aromatic plants of tropical central Africa. Part XXXII. Chemical composition and antifungal activity of thirteen essential oils from aromatic plants of Cameroon, Flavour Fragr. J., 1998, 13, 2, 107-114, https://doi.org/10.1002/(SICI)1099-1026(199803/04)13:2<107::AID-FFJ701>3.0.CO;2-G . [all data]

Salgueiro, Vila, et al., 1997
Salgueiro, L.R.; Vila, R.; Tomi, F.; Figueiredo, A.C.; Barroso, J.G.; Cañigueral, S.; Casanova, J.; da Cunha, A.P.; Adzet, T., Variability of essential oils of Thymus caespititius from Portugal, Phytochemistry, 1997, 45, 2, 307-311, https://doi.org/10.1016/S0031-9422(96)00872-2 . [all data]

Zunino, Novillo-Newton, et al., 1997
Zunino, M.P.; Novillo-Newton, M.; Maestri, D.M.; Zygadlo, J.A., Composition of the essential oil of Baccharis crispa Spreng. and Baccharis salicifolia Pers. grown in Cordoba (Argentina), Flavour Fragr. J., 1997, 12, 6, 405-407, https://doi.org/10.1002/(SICI)1099-1026(199711/12)12:6<405::AID-FFJ667>3.0.CO;2-R . [all data]

Zygadlo, Ariza-Espinar, et al., 1997
Zygadlo, J.A.; Ariza-Espinar, L.; Velasco-Negueruela, A.; Perez-Alonso, M.J., Volatile constituents of Stevia achalensis hieronymus, Flavour Fragr. J., 1997, 12, 4, 297-299, https://doi.org/10.1002/(SICI)1099-1026(199707)12:4<297::AID-FFJ625>3.0.CO;2-2 . [all data]

Orav, Kailas, et al., 1996
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Rajeswara, Kaul, et al., 1996
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Thanh, Dung, et al., 1996
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Gopalakrishnan, Menon, et al., 1993
Gopalakrishnan, M.; Menon, N.; Padmakumari, K.P.; Jayalekshmy, A.; Narayanan, C.S., GC Analysis and Odor Profiles of Four New Indian Genotypes of Piper nigrum L., J. Essent. Oil Res., 1993, 5, 3, 247-253, https://doi.org/10.1080/10412905.1993.9698217 . [all data]

Jantan and Goh, 1990
Jantan, I.; Goh, S.H., The essential oils of Cinnamomum mollissimum as natural sources of safrole and benzyl benzoate, J. Tropical Forest Sci., 1990, 2, 3, 252-259. [all data]

Notes

Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References

Symbols used in this document:

T_end Final temperature

T_start Initial temperature
Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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