(E)-β-Famesene

Formula: C₁₅H₂₄
Molecular weight: 204.3511
IUPAC Standard InChI: InChI=1S/C15H24/c1-6-14(4)10-8-12-15(5)11-7-9-13(2)3/h6,9,12H,1,4,7-8,10-11H2,2-3,5H3/b15-12+
IUPAC Standard InChIKey: JSNRRGGBADWTMC-NTCAYCPXSA-N
CAS Registry Number: 18794-84-8
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.
Species with the same structure:
Stereoisomers:
Other names: 1,6,10-Dodecatriene, 7,11-dimethyl-3-methylene-, (E)-; 7,11-Dimethyl-3-methylene-1,6,10-dodecatriene, trans; β-Farnesene (E); β-trans-Farnesene; Farnesene (E, β); t-β-Farnesene; trans-β-Farnesene; (6E)-7,11-Dimethyl-3-methylene-1,6,10-dodecatriene; 502-60-3; (E)-β-Farnesene; β-Farnesene; beta-(E)-Farnesene; 7,11-Dimethyl-3-methylene-1,6,10-dodecatriene; trans-β-farnesen; (E)-7,11-dimethyl-3-methylenedodeca-1,6,10-triene
Information on this page:
Other data available:
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Van Den Dool and Kratz 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	BP-1	BP-1	DB-5	HP-5	HP-5MS
Column length (m)	50.	50.	30.	30.	30.
Carrier gas	He	He	He	N2	He
Substrate
Column diameter (mm)	0.22	0.22	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.	50.	60.
T_end (C)	220.	220.	240.	220.	280.
Heat rate (K/min)	2.	2.	3.	5.	3.
Initial hold (min)				10.
Final hold (min)	20.	20.
I	1448.	1448.	1459.	1458.	1459.
Reference	Boti, Koukoua, et al., 2007	Duquesnoy, Castola, et al., 2007	Flamini, Cioni, et al., 2007	Flamini, Tebano, et al., 2007	Kundakovic, Fokialakis, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	RTX-1	RTX-1	SPB-1	HP-5MS	DB-5
Column length (m)	60.	60.	30.	30.	25.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.22	0.22	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.	60.
T_end (C)	230.	230.	250.	280.	200.
Heat rate (K/min)	2.	2.	5.	4.	2.
Initial hold (min)			3.	5.
Final hold (min)	35.	35.	15.		60.
I	1452.	1450.	1449.	1457.	1457.
Reference	Paolini J., Costa J., et al., 2007	Paolini, Muselli, et al., 2007	Radulovic, Lazarevic, et al., 2007	Radulovic, Lazarevic, et al., 2007	Rout, Rao, 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-5MS	DB-5	DB-1	BP-1
Column length (m)	30.	30.	30.	60.	50.
Carrier gas	He	He	He	N2	He
Substrate
Column diameter (mm)	0.25	0.25	0.22	0.25	0.22
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	55.	60.	60.
T_end (C)	260.	280.	240.	250.	220.
Heat rate (K/min)	5.	4.	3.	5.	2.
Initial hold (min)		5.	2.
Final hold (min)			15.	10.	20.
I	1461.	1454.	1457.	1453.	1448.
Reference	Sabulal, Dan, et al., 2007	Saroglou, Arfan, et al., 2007	Silva, Barbosa, et al., 2007	Sonboli, Azizian, et al., 2007	Boti, Bighelli, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	RTX-1	HP-5	BP-1	HP-5MS	DB-5
Column length (m)	60.	30.	50.	30.	50.
Carrier gas	He	N2	He	He	N2
Substrate
Column diameter (mm)	0.22	0.25	0.22	0.25	0.2
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.32
T_start (C)	60.	60.	60.	60.	60.
T_end (C)	230.	220.	220.	280.	220.
Heat rate (K/min)	2.	5.	2.	3.	5.
Initial hold (min)		10.			3.
Final hold (min)	45.		20.		5.
I	1447.	1456.	1446.	1455.	1458.
Reference	Cavalli, Tomi, et al., 2006	Flamini, Tebano, et al., 2006	Gonny, Cavaleiro, et al., 2006	Kukic J., Petrovic S., et al., 2006	Masoudi, Esmaeili, 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	SPB-1	OV-1	HP-5MS	HP-5MS
Column length (m)	30.	30.	25.	30.	30.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.32	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.2	0.25	0.25	0.25
T_start (C)	60.	70.	50.	60.	60.
T_end (C)	280.	220.	220.	280.	300.
Heat rate (K/min)	3.	3.	3.	4.	3.
Initial hold (min)			1.	5.
Final hold (min)		15.	5.
I	1450.	1447.	1459.	1453.	1457.
Reference	Pavlovic, Tzakou, et al., 2006	Pinto, Pina-Vaz, et al., 2006	Rubiolo P., Matteodo M., et al., 2006	Saroglou, Dorizas, et al., 2006	Silva-Brandão, Solferini, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	CP Sil 5 CB	CP Sil 5 CB	DB-1	BP-1
Column length (m)	30.	25.	25.	30.	50.
Carrier gas	He	H2	He	N2	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.22
Phase thickness (μm)	0.25		0.4	0.25	0.25
T_start (C)	40.	80.	80.	50.	60.
T_end (C)	300.	270.	270.	200.	220.
Heat rate (K/min)	4.	10.	10.	5.	2.
Initial hold (min)	5.
Final hold (min)					20.
I	1458.	1446.	1446.	1445.	1450.
Reference	Vundac, Pfeifhofer, et al., 2006	Ziegenbein, Hanssen, et al., 2006	Ziegenbein, Hanssen, et al., 2006, 2	Agnaniet, Makani, et al., 2005	Boti J.B., Koukoua G., et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	SE-54	HP-5	DB-1	DB-1	BP-1
Column length (m)	50.	30.	30.	30.	50.
Carrier gas	H2	N2	N2	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.32	0.25	0.22
Phase thickness (μm)	0.27	0.25	0.25	0.25	0.25
T_start (C)	50.	60.	50.	40.	60.
T_end (C)	300.	220.	260.	250.	220.
Heat rate (K/min)	5.	5.	2.	3.	2.
Initial hold (min)		10.	3.
Final hold (min)			5.	20.	20.
I	1451.	1457.	1449.	1443.	1450.
Reference	Brantner, Pfeifhofer, et al., 2005	Celik, Gokturk, et al., 2005	Dob, Berramdane, et al., 2005	Fanciullino, Gancel, et al., 2005	Ferrari, Tomi, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	HP-5	DB-1	DB-1	DB-5
Column length (m)	30.	30.	30.	25.	25.
Carrier gas	N2	N2	He		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.	60.	40.	60.	75.
T_end (C)	220.	220.	250.	180.	210.
Heat rate (K/min)	5.	5.	3.	3.	3.
Initial hold (min)	10.	10.		10.	10.
Final hold (min)			20.	10.	1.
I	1460.	1458.	1438.	1456.	1458.
Reference	Flamini, Luigi Cioni, et al., 2005	Flamini, Luigi Cioni, et al., 2005, 2	Gancel, Ollitrault, et al., 2005	bin Jantan, Yalvema, et al., 2005	bin Jantan, Yalvema, et al., 2005, 2
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	DB-5MS	SE-54	DB-1	Mega 5MS
Column length (m)	30.	60.	25.	30.	30.
Carrier gas	He	He	H2	N2	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.2	0.25	0.25
T_start (C)	60.	40.	50.	50.	40.
T_end (C)	260.	200.	250.	200.	240.
Heat rate (K/min)	3.	2.	4.	5.	3.
Initial hold (min)					2.
Final hold (min)		20.
I	1455.	1456.	1457.	1445.	1452.
Reference	Javidnia, Miri, et al., 2005	Seo and Baek, 2005	Simionatto, Porto, et al., 2005	Tchoumbougnang, Zollo, et al., 2005	Verzera, Trozzi, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5MS	SPB-1	SPB-1	HP-5MS	HP-5
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.2	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.2	0.25	0.25
T_start (C)	60.	70.	70.	60.	60.
T_end (C)	280.	220.	220.	280.	240.
Heat rate (K/min)	3.	3.	3.	3.	3.
Initial hold (min)
Final hold (min)		15.	15.
I	1454.	1446.	1444.	1456.	1459.
Reference	Aligiannis, Kalpoutzakis, et al., 2004	Antunes, Sevinate-Pinto, et al., 2004	Cavaleiro, Salgueiro, et al., 2004	Chorianopoulos, Kalpoutzakis, et al., 2004	Flamini, Bader, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	BP-1	HP-5MS	HP-5	SPB-1
Column length (m)	30.	50.	30.	30.	30.
Carrier gas	N2		He	He	He
Substrate
Column diameter (mm)	0.25	0.22	0.25	0.25	0.2
Phase thickness (μm)	0.25	0.25	0.25		0.2
T_start (C)	60.	60.	60.	60.	70.
T_end (C)	220.	220.	280.	260.	220.
Heat rate (K/min)	5.	2.	4.	3.	3.
Initial hold (min)	10.		5.
Final hold (min)		20.			15.
I	1459.	1446.	1457.	1458.	1447.
Reference	Flamini, Luigi Cioni, et al., 2004	Gonny, Bradesi, et al., 2004	Grujic-Jovanovic, Skaltsa, et al., 2004	Javidnia, Miri, et al., 2004	Moldão-Martins, Beirão-da-Costa, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5MS	RSL-200	HP-5MS	DB-5MS	DB-5MS
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	He	H2	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	0.25
T_start (C)	50.	40.	60.	40.	40.
T_end (C)	300.	280.	280.	200.	200.
Heat rate (K/min)	5.	6.	3.	4.	4.
Initial hold (min)	5.	5.		5.	5.
Final hold (min)		5.		20.	20.
I	1457.	1467.	1437.	1456.	1454.
Reference	Mumm, Tiemann, et al., 2004	Ngassoum, Ousmaila, et al., 2004	Tzakou, Vagias, et al., 2004	Yu, Kim, et al., 2004	Zheng, Kim, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5	BPX-5	HP-5	DB-5	SPB-1
Column length (m)	25.	30.	30.	30.	30.
Carrier gas	N2	N2	N2	N2	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.2
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.2
T_start (C)	75.	75.	60.	60.	70.
T_end (C)	210.	210.	220.	220.	220.
Heat rate (K/min)	3.	3.	5.	5.	3.
Initial hold (min)	10.	10.	10.	10.
Final hold (min)	1.	1.			15.
I	1458.	1459.	1459.	1459.	1447.
Reference	bin Ahmad and bin Jantan, 2003	bin Ahmad and bin Jantan, 2003, 2	Angelini, Carpanese, et al., 2003	Bader, Caponi, et al., 2003	Cavaleiro, Salgueiro, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	RTX-1	Ultra-2	Optima 5	HP-5	HP-5
Column length (m)	60.	25.	25.	30.	30.
Carrier gas	He	H2	He	N2	N2
Substrate
Column diameter (mm)	0.22	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.33	0.25	0.25	0.25
T_start (C)	60.	40.	60.	60.	60.
T_end (C)	230.	280.	280.	220.	220.
Heat rate (K/min)	2.	3.	3.	5.	5.
Initial hold (min)		2.		10.	10.
Final hold (min)	45.	10.	20.
I	1447.	1455.	1471.	1455.	1460.
Reference	Cavalli, Tomi, et al., 2003	Ceva-Antunes, Bizzo, et al., 2003	Chosson, Vérité, et al., 2003	Dural, Bagci, et al., 2003	Ertugrul, Dural, 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	HP-5	DB-1	PE-5	DB-5
Column length (m)	30.	30.	30.	30.	25.
Carrier gas	N2	N2	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
T_start (C)	60.	60.	40.	40.	60.
T_end (C)	220.	220.	250.	280.	260.
Heat rate (K/min)	5.	5.	3.	3.	4.
Initial hold (min)	10.	10.
Final hold (min)			20.
I	1459.	1459.	1438.	1457.	1459.
Reference	Flamini, Luigi Cioni, et al., 2003	Flamini, Luigi Cioni, et al., 2003, 2	Gancel, Ollitrault, et al., 2003	Isidorov and Vinogorova, 2003	Javidnia, Miri, 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	BPX-5	HP-5	SPB-1	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	0.20	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.20	0.25
T_start (C)	60.	60.	60.	70.	70.
T_end (C)	240.	240.	280.	220.	230.
Heat rate (K/min)	3.	3.	4.	3.	4.
Initial hold (min)		2.	5.		2.
Final hold (min)				15.	20.
I	1458.	1455.	1457.	1447.	1452.
Reference	Macchioni, Cioni, et al., 2003	Shellie, Marriott, et al., 2003	Skaltsa, Demetzos, et al., 2003	Cavaleiro, Salgueiro, et al., 2002	Choi, Kim. M.-S.L., 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	CP Sil 5 CB	DB-1	BP-1	HP-1
Column length (m)	30.	50.	25.	50.	24.
Carrier gas	He	H2	N2	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.22	0.32
Phase thickness (μm)	0.25	0.15		0.25	0.17
T_start (C)	60.	40.	60.	60.	60.
T_end (C)	240.	300.	180.	220.	250.
Heat rate (K/min)	3.	4.	3.	2.	4.
Initial hold (min)		3.	10.		2.
Final hold (min)			10.	20.	20.
I	1460.	1458.	1445.	1448.	1447.
Reference	Flamini, Cioni, et al., 2002	Heinrich, Pfeifhofer, et al., 2002	bin Jantan and bin Ahmad, 2002	Lota, de Rocca Serra, et al., 2002	Nath, Sarma, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	RTX-5	RTX-5	HP-5	BP-1	DB-5
Column length (m)	30.	30.	30.	50.	30.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.22	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	45.	45.	60.	60.	60.
T_end (C)	250.	250.	280.	230.	300.
Heat rate (K/min)	3.	3.	3.	2.	5.
Initial hold (min)	6.	6.	5.		3.
Final hold (min)				35.
I	1458.	1461.	1456.	1447.	1459.
Reference	Shellie, Mondello, et al., 2002	Shellie, Mondello, et al., 2002	Aligiannis, Kalpoutzakis, et al., 2001	Bianchini, Tomi, et al., 2001	Bortolomeazzi, Berno, et al., 2001
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	HP-1	HP-5	DB-5	HP-5MS
Column length (m)	30.	60.	50.	30.	30.
Carrier gas	He	He	He	H2	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.	50.	50.	60.	60.
T_end (C)	380.	250.	250.	240.	280.
Heat rate (K/min)	3.	2.5	2.5	3.	4.
Initial hold (min)		5.	5.		5.
Final hold (min)
I	1450.	1448.	1458.	1456.	1457.
Reference	Couladis, Tsortanidou, et al., 2001	Guilliard, Delgado, et al., 2001	Guilliard, Delgado, et al., 2001	Nogueira, Bittrich, et al., 2001	Skaltsa, Mavrommati, et al., 2001
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	BP-1
Column length (m)	60.	30.	30.	30.	50.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.22
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	40.	60.	50.	50.	60.
T_end (C)	290.	300.	280.	280.	230.
Heat rate (K/min)	4.	5.	4.	4.	2.
Initial hold (min)	2.	3.	5.	5.
Final hold (min)	5.				35.
I	1447.	1459.	1459.	1453.	1448.
Reference	Bartley and Jacobs, 2000	Bortolomeazzi, Pizzale, et al., 2000	Lazari, Skaltsa, et al., 2000	Lazari, Skaltsa, et al., 2000, 2	Lota, de Rocca Serra, et al., 2000
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	RTX-5	HP-5	DB-5	Mega 5MS	DB-1
Column length (m)	10.	30.	30.	30.	60.
Carrier gas	He	He	N2	He	He
Substrate
Column diameter (mm)	0.1	0.25	0.25	0.25	0.32
Phase thickness (μm)	0.1	0.25	0.25	0.25
T_start (C)	50.	70.	70.	40.	60.
T_end (C)	350.	230.	230.	240.	230.
Heat rate (K/min)	12.3	2.	2.	3.	3.
Initial hold (min)				2.
Final hold (min)					5.
I	1461.	1456.	1456.	1452.	1448.
Reference	Mondello, Zappia, et al., 2000	Song, Sawamura, et al., 2000	Song, Sawamura, et al., 2000, 2	Verzera, Trozzi, et al., 2000	Javidnia and Shafiee, 1999
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	BP-1	BP-1	BP-1	Methyl Silicone
Column length (m)	30.	50.	50.	50.	50.
Carrier gas	He	He	He	He	N2
Substrate
Column diameter (mm)	0.25	0.22	0.22	0.22	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.17
T_start (C)	50.	60.	60.	60.	80.
T_end (C)	280.	230.	230.	220.	200.
Heat rate (K/min)	4.	2.	2.	2.	2.
Initial hold (min)	5.
Final hold (min)		35.	35.	20.
I	1456.	1448.	1448.	1448.	1459.
Reference	Lazari, Skaltsa, et al., 1999	Lota, Serra, et al., 1999	Lota, Serra, et al., 1999	Mazzoni, Tomi, et al., 1999	Sumathykutty, Rao, et al., 1999
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	OV-1	DB-5	DB-5	BP-1	BP-1
Column length (m)	25.	30.	30.	50.	50.
Carrier gas			H2	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.22	0.22
Phase thickness (μm)	0.3	0.25	0.25	0.25	0.25
T_start (C)	50.	50.	60.	60.	60.
T_end (C)	200.	250.	240.	230.	230.
Heat rate (K/min)	3.	3.	3.	2.	2.
Initial hold (min)	1.
Final hold (min)	20.			35.	35.
I	1433.	1482.	1459.	1447.	1441.
Reference	Bicchi, Rubiolo, et al., 1998	Isidorov, Zenkevich, et al., 1998	Nogueira, Marsaioli, et al., 1998	Mariotti, Costa, et al., 1997	Mariotti, Tomi, et al., 1997
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary
Active phase	HP-101	OV-1	OV-1
Column length (m)	50.	30.	30.
Carrier gas	N2	He	He
Substrate
Column diameter (mm)	0.25	0.5	0.5
Phase thickness (μm)		0.8	0.8
T_start (C)	70.	40.	40.
T_end (C)	200.	220.	220.
Heat rate (K/min)	3.	2.	2.
Initial hold (min)
Final hold (min)
I	1451.	1444.	1447.
Reference	Chung, Eiserich, et al., 1993	De Pooter, Omar, et al., 1985	De Pooter, Omar, et al., 1985
Comment	MSDC-RI	MSDC-RI	MSDC-RI

References

Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, Notes

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Flamini, Luigi Cioni, et al., 2004
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Grujic-Jovanovic, Skaltsa, et al., 2004
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Javidnia, Miri, et al., 2004
Javidnia, K.; Miri, R.; Kamalinejad, M.; Sarkarzadeh, H.; Jamalian, A., Chemical composition of the essential oils of Anthemis altissima L. grown in Iran, Flavour Fragr. J., 2004, 19, 3, 213-216, https://doi.org/10.1002/ffj.1277 . [all data]

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Moldão-Martins, M.; Beirão-da-Costa, S.; Neves, C.; Cavaleiro, C.; Salgueiro, L.; Beirão-da-Costa, M.L., Olive oil flavoured by the essential oils of Mentha × piperita and Thymus mastichina L., Food Qual. Pref., 2004, 15, 5, 447-452, https://doi.org/10.1016/j.foodqual.2003.08.001 . [all data]

Mumm, Tiemann, et al., 2004
Mumm, R.; Tiemann, T.; Schulz, S.; Hilker, M., Analysis of volatiles from black pine (Pinus nigra): significance of wounding and egg deposition by a herbivorous sawfly, Phytochemistry, 2004, 65, 24, 3221-3230, https://doi.org/10.1016/j.phytochem.2004.10.010 . [all data]

Ngassoum, Ousmaila, et al., 2004
Ngassoum, M.B.; Ousmaila, H.; Ngamo, L.T.; Maponmetsem, P.M.; Jirovetz, L.; Buchbauer, G., Aroma compounds of essential oils of two varieties of the spice plant Ocimum canum Sims from northern Cameroon, J. Food Comp. Anal., 2004, 17, 2, 197-204, https://doi.org/10.1016/j.jfca.2003.08.002 . [all data]

Tzakou, Vagias, et al., 2004
Tzakou, O.; Vagias, C.; Gani, A.; Yannitsaros, A., Volatile constituents of essential oils isolated at different growth stages from three Conyza species growing in Greece, Flavour Fragr. J., 2004, 19, 425-428. [all data]

Yu, Kim, et al., 2004
Yu, E.J.; Kim, T.H.; Kim, K.H.; Lee, H.J., Aroma-active compounds of Pinus densiflora (red pine) needles, Flavour Fragr. J., 2004, 19, 6, 532-537, https://doi.org/10.1002/ffj.1337 . [all data]

Zheng, Kim, et al., 2004
Zheng, C.H.; Kim, T.H.; Kim, K.H.; Leem, Y.H.; Lee, H.J., Characterization of potent aroma compounds in Chrysanthemum coronarium L. (Garland) using aroma extract dilution analysis, Flavour Fragr. J., 2004, 19, 5, 401-405, https://doi.org/10.1002/ffj.1447 . [all data]

bin Ahmad and bin Jantan, 2003
bin Ahmad, F.; bin Jantan, I., Chemical constituents of the essential oils of Goniothalamus uvariodes King, Flavour Fragr. J., 2003, 18, 2, 128-130, https://doi.org/10.1002/ffj.1142 . [all data]

bin Ahmad and bin Jantan, 2003, 2
bin Ahmad, F.; bin Jantan, I., The essential oils of Boesenbergia stenophylla R. M. Sm. as natural sources of methyl (E)-cinnamate, Flavour Fragr. J., 2003, 18, 6, 485-486, https://doi.org/10.1002/ffj.1227 . [all data]

Angelini, Carpanese, et al., 2003
Angelini, L.G.; Carpanese, G.; Cioni, P.L.; Morelli, I.; Macchia, M.; Flamini, G., Essential oils from Mediterranean lamiaceae as weed germination inhibitors, J. Agric. Food Chem., 2003, 51, 21, 6158-6164, https://doi.org/10.1021/jf0210728 . [all data]

Bader, Caponi, et al., 2003
Bader, A.; Caponi, C.; Cioni, P.L.; Flamini, G.; Morelli, I., Acorenone in the essential oil of flowering aerial parts of Seseli tortuosum L., Flavour Fragr. J., 2003, 18, 1, 57-58, https://doi.org/10.1002/ffj.1154 . [all data]

Cavaleiro, Salgueiro, et al., 2003
Cavaleiro, C.; Salgueiro, L.R.; da Cunha, A.P.; Figueiredo, A.C.; Barroso, J.G.; Bighelli, A.; Casanova, J., Composition and variability of the essential oils of the leaves and berries from Juniperus navicularis, Biochem. Syst. Ecol., 2003, 31, 2, 193-201, https://doi.org/10.1016/S0305-1978(02)00080-7 . [all data]

Cavalli, Tomi, et al., 2003
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Ceva-Antunes, Bizzo, et al., 2003
Ceva-Antunes, P.M.N.; Bizzo, H.R.; Alves, S.M.; Antunes, O.A.C., Analysis of volatile compounds of taperebá (Spondias mombin L.) and Cajá (Spondias mombin L.) by simultaneous distillation and extraction (SDE) and solid phase microextraction (SPME), J. Agric. Food Chem., 2003, 51, 5, 1387-1392, https://doi.org/10.1021/jf025873m . [all data]

Chosson, Vérité, et al., 2003
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Dural, Bagci, et al., 2003
Dural, H.; Bagci, Y.; Ertugrul, K.; Demirelma, H.; Flamini, G.; Cioni, P.L.; Morelli, I., Essential oil composition of two endemic Centaurea species from Turkey, Centaurea mucronifera and Centaurea chrysantha, collected in the same habitat, Biochem. Syst. Ecol., 2003, 31, 12, 1417-1425, https://doi.org/10.1016/S0305-1978(03)00128-5 . [all data]

Ertugrul, Dural, et al., 2003
Ertugrul, K.; Dural, H.; Tugay, O.; Flamini, G.; Cioni, P.L.; Morelli, I., Essential oils from flowers of Centaurea kotschyi var. kotschyi and C. kotschyi var. decumbens from Turkey, Flavour Fragr. J., 2003, 18, 2, 95-97, https://doi.org/10.1002/ffj.1168 . [all data]

Flamini, Luigi Cioni, et al., 2003
Flamini, G.; Luigi Cioni, P.; Morelli, I., Differences in the fragrances of pollen, leaves, and floral parts of garland (Chrysanthemum coronarium) and composition of the essential oils from flowerheads and leaves, J. Agric. Food Chem., 2003, 51, 8, 2267-2271, https://doi.org/10.1021/jf021050l . [all data]

Flamini, Luigi Cioni, et al., 2003, 2
Flamini, G.; Luigi Cioni, P.; Morelli, I., Variability of the essential oil of Viola etrusca, Ann. Bot. Rome, 2003, 91, 4, 493-497, https://doi.org/10.1093/aob/mcg039 . [all data]

Gancel, Ollitrault, et al., 2003
Gancel, A.-L.; Ollitrault, P.; Froelicher, Y.; Tomi, F.; Jacquemond, C.; Luro, F.; Brillouet, J.-M., Leaf volatile compounds of seven citrus somatic tetraploid hybrids sharing willow leaf mandarin (Citrus deliciosa Ten.) as their common parent, J. Agric. Food Chem., 2003, 51, 20, 6006-6013, https://doi.org/10.1021/jf0345090 . [all data]

Isidorov and Vinogorova, 2003
Isidorov, V.A.; Vinogorova, V.T., GC-MS analysis of compounds extracted from buds of Populus balsamifera and Populus nigra, Z. Naturforsch. C:, 2003, 58, 355-360. [all data]

Javidnia, Miri, et al., 2003
Javidnia, K.; Miri, R.; Azarpira, A.; Tabaei, S.M.H., Composition of the essential oil of Stachys setifera C.A. Mey ssp. iranica growing in Iran, Flavour Fragr. J., 2003, 18, 4, 299-300, https://doi.org/10.1002/ffj.1165 . [all data]

Macchioni, Cioni, et al., 2003
Macchioni, F.; Cioni, P.L.; Flamini, G.; Morelli, I.; Maccioni, S.; Ansaldi, M., Chemical composition of essential oils from needles, branches and cones of Pinus pinea, P. halepensis, P. pinaster and P. nigra from central Italy, Flavour Fragr. J., 2003, 18, 2, 139-143, https://doi.org/10.1002/ffj.1178 . [all data]

Shellie, Marriott, et al., 2003
Shellie, R.A.; Marriott, P.J.; Huie, C.W., Comprehensive two-dimensional gas chromatography (GC × GC) and GC × GC-quadrupole MS analysis of Asian and American ginseng, J. Sep. Sci., 2003, 26, 12-13, 1185-1192, https://doi.org/10.1002/jssc.200301404 . [all data]

Skaltsa, Demetzos, et al., 2003
Skaltsa, H.D.; Demetzos, C.; Lazari, D.; Sokovic, M., Essential oil analysis and antimicrobial activity of eight Stachys species from Greece, Phytochemistry, 2003, 64, 3, 743-752, https://doi.org/10.1016/S0031-9422(03)00386-8 . [all data]

Cavaleiro, Salgueiro, et al., 2002
Cavaleiro, C.; Salgueiro, L.R.; Antunes, T.; Sevinate-Pinto, I.; Barroso, J.G., Composition of the essential oil and micromorphology of trichomes of Teucrium salviastrum, an endemic species from Portugal, Flavour Fragr. J., 2002, 17, 4, 287-291, https://doi.org/10.1002/ffj.1068 . [all data]

Choi, Kim. M.-S.L., et al., 2002
Choi, H.-S.; Kim. M.-S.L.; Sawamura, M., Constituents of the essential oil of cnidium officinale Makino, a Korean medicinal plant, Flavour Fragr. J., 2002, 17, 1, 49-53, https://doi.org/10.1002/ffj.1038 . [all data]

Flamini, Cioni, et al., 2002
Flamini, G.; Cioni, P.L.; Morelli, I., Analysis of the essential oil of the aerial parts of Viola etrusca from Monte Labbro (South Tuscany, Italy) and in vivo analysis of flower volatiles using SPME, Flavour Fragr. J., 2002, 17, 2, 147-149, https://doi.org/10.1002/ffj.1060 . [all data]

Heinrich, Pfeifhofer, et al., 2002
Heinrich, G.; Pfeifhofer, H.W.; Stabentheiner, E.; Sawidis, T., Glandular hairs of Sigesbeckia jorullensis Kunth (Asteraceae): morphology, histochemistry and composition of essential oil, Ann. Bot. Rome, 2002, 89, 4, 459-469, retrieved from http://www.aob.oupjournals.org, https://doi.org/10.1093/aob/mcf062 . [all data]

bin Jantan and bin Ahmad, 2002
bin Jantan, I.; bin Ahmad, F., Chemical constituents of the essential oils of Goniothalamus malayanus Hook. f. and Thoms., Flavour Fragr. J., 2002, 17, 5, 372-374, https://doi.org/10.1002/ffj.1107 . [all data]

Lota, de Rocca Serra, et al., 2002
Lota, M.-L.; de Rocca Serra, D.; Tomi, F.; Jacquemond, C.; Casanova, J., Volatile components of peel and leaf oils of lemon and lime species, J. Agric. Food Chem., 2002, 50, 4, 796-805, https://doi.org/10.1021/jf010924l . [all data]

Nath, Sarma, et al., 2002
Nath, S.C.; Sarma, K.K.; Vajezikova, I.; Leclercq, P.A., Comparison of volatile inflorescence oils and taxonomy of certain Cymbopogon taxa described as Cymbopogon flexuosus (Nees ex Steud.) Wats., Biochem. Syst. Ecol., 2002, 30, 2, 151-162, https://doi.org/10.1016/S0305-1978(01)00066-7 . [all data]

Shellie, Mondello, et al., 2002
Shellie, R.; Mondello, L.; Marriott, P.; Dugo, G., Characterisation of lavender essential oils by using gas chromatography-mass spectrometry with correlation of linear retention indices and comparison with comprehensive two-dimensional gas chromatography, J. Chromatogr. A, 2002, 970, 1-2, 225-234, https://doi.org/10.1016/S0021-9673(02)00653-2 . [all data]

Aligiannis, Kalpoutzakis, et al., 2001
Aligiannis, N.; Kalpoutzakis, E.; Chinou, I.B.; Mitaku, S.; Gikas, E.; Tsarbopoulos, A., Composition and antimicrobial activity of the essential oils of five taxa of Sideritis from Greece, J. Agric. Food Chem., 2001, 49, 2, 811-815, https://doi.org/10.1021/jf001018w . [all data]

Bianchini, Tomi, et al., 2001
Bianchini, A.; Tomi, P.; Costa, J.; Bernardini, A.F., Composition of Helichrysum italicum (Roth) G. Don fil. subsp. italicum essential oils from Corsica (France), Flavour Fragr. J., 2001, 16, 1, 30-34, https://doi.org/10.1002/1099-1026(200101/02)16:1<30::AID-FFJ941>3.0.CO;2-F . [all data]

Bortolomeazzi, Berno, et al., 2001
Bortolomeazzi, R.; Berno, P.; Pizzale, L.; Conte, L.S., Sesquiterpene, alkene, and alkane hydrocarbons in virgin olive oils of different varieties and geographical origins, J. Agric. Food Chem., 2001, 49, 7, 3278-3283, https://doi.org/10.1021/jf001271w . [all data]

Couladis, Tsortanidou, et al., 2001
Couladis, M.; Tsortanidou, V.; Francisco-Ortega, J.; Santos-Guerra, A.; Harvala, C., Composition of the essential oils of Argyranthemum species growing in the Canary Islands, Flavour Fragr. J., 2001, 16, 2, 103-106, https://doi.org/10.1002/ffj.954 . [all data]

Guilliard, Delgado, et al., 2001
Guilliard, M.; Delgado, W.; Martínez, J.R.; Stashenko, E., Determination of the enantiomeric purity of carvone, main component of Colombian Lippia alba (Mill) oil by means of bidimensional gas chromatography (23rd International Symposium on Capillary Chromatography), 2001, retrieved from http://www.richrom.com/assets/CD23PDF/i01.pdf. [all data]

Nogueira, Bittrich, et al., 2001
Nogueira, P.C.L.; Bittrich, V.; Shepherd, G.J.; Lopes, A.V.; Marsaioli, A.J., The ecological and taxonomic importance of flower volatiles of Clusia species (Guttiferae), Phytochemistry, 2001, 56, 5, 443-452, https://doi.org/10.1016/S0031-9422(00)00213-2 . [all data]

Skaltsa, Mavrommati, et al., 2001
Skaltsa, H.D.; Mavrommati, A.; Constantinidis, T., A chemotaxonomic investigation of volatile constituents in Stachys subsect. Swainsonianeae (Labiatae), Phytochemistry, 2001, 57, 2, 235-244, https://doi.org/10.1016/S0031-9422(01)00003-6 . [all data]

Bartley and Jacobs, 2000
Bartley, J.P.; Jacobs, A.L., Effects of drying on flavour compounds in Australian-grown ginger (Zingiber officinale), J. Sci. Food Agric., 2000, 80, 2, 209-215, https://doi.org/10.1002/(SICI)1097-0010(20000115)80:2<209::AID-JSFA516>3.0.CO;2-8 . [all data]

Bortolomeazzi, Pizzale, et al., 2000
Bortolomeazzi, R.; Pizzale, L.; Vichi, S.; Piasenzotto, L.; Conte, L.S., GC-MS Characterization of sesquiterpenic hydrocarbons in virgin olive oils, Proceedings 23rd ISCC; CD-ROM, 2000, retrieved from http://www.richrom.com/assets/CD23PDF. [all data]

Lazari, Skaltsa, et al., 2000
Lazari, D.M.; Skaltsa, H.D.; Constantinidis, T., Volatile constituents of Cerastium candidissimum, a Greek endemic species, Flavour Fragr. J., 2000, 15, 3, 174-176, https://doi.org/10.1002/1099-1026(200005/06)15:3<174::AID-FFJ886>3.0.CO;2-Y . [all data]

Lazari, Skaltsa, et al., 2000, 2
Lazari, D.M.; Skaltsa, H.D.; Constantinidis, T., Volatile constituents of Centaurea pelia DC., C. thessala Hausskn. subsp. drakiensis (Freyn Sint.) Georg. and C. zuccariniana DC. from Greece, Flavour Fragr. J., 2000, 15, 1, 7-11, https://doi.org/10.1002/(SICI)1099-1026(200001/02)15:1<7::AID-FFJ860>3.0.CO;2-3 . [all data]

Lota, de Rocca Serra, et al., 2000
Lota, M.-L.; de Rocca Serra, D.; Tomi, F.; Casanova, J., Chemical variability of peel and leaf essential oils of mandarins from Citrus reticulata Blanco, Biochem. Syst. Ecol., 2000, 28, 1, 61-78, https://doi.org/10.1016/S0305-1978(99)00036-8 . [all data]

Mondello, Zappia, et al., 2000
Mondello, L.; Zappia, G.; Dugo, P.; Dugo, G.; Bonaccorsi, I.; Dugo, G., Identification of complex samples by Fast-GC/MS using linear retention indices in conjunction with the MS-library, Proceedings, 23rd ISCC; CD-ROM, 2000, retrieved from http://www.richrom.com/assets/CD23PDF. [all data]

Song, Sawamura, et al., 2000
Song, H.S.; Sawamura, M.; Ito, T.; Kawashimo, K.; Ukeda, H., Quantitative determination of characteric flavour of Citrus junos (yuzu) peel oil, Flavour Fragr. J., 2000, 15, 4, 245-250, https://doi.org/10.1002/1099-1026(200007/08)15:4<245::AID-FFJ904>3.0.CO;2-V . [all data]

Song, Sawamura, et al., 2000, 2
Song, H.S.; Sawamura, M.; Ito, T.; Ido, A.; Ukeda, H., Quantitative determination and characteristic flavour of daidai (Citrus aurantium L. var. cyathifera Y. Tanaka) peel oil, Flavour Fragr. J., 2000, 15, 5, 323-328, https://doi.org/10.1002/1099-1026(200009/10)15:5<323::AID-FFJ918>3.0.CO;2-J . [all data]

Verzera, Trozzi, et al., 2000
Verzera, A.; Trozzi, A.; Cotroneo, A.; Lorenzo, D.; Dellacassa, E., Uruguayan essential oil. 12. Composition of Nova and Satsuma mandarin oils, J. Agric. Food Chem., 2000, 48, 7, 2903-2909, https://doi.org/10.1021/jf990734z . [all data]

Javidnia and Shafiee, 1999
Javidnia, K.; Shafiee, A., Constituents of the essential oil of Matricaria decipiens C. Koch, Flavour Fragr. J., 1999, 14, 3, 153-155, https://doi.org/10.1002/(SICI)1099-1026(199905/06)14:3<153::AID-FFJ792>3.0.CO;2-V . [all data]

Lazari, Skaltsa, et al., 1999
Lazari, D.M.; Skaltsa, H.D.; Constantinidis, T., Essential oils of Marrubium velutinum Sm. and Marrubium peregrinum L., growing wild in Greece, Flavour Fragr. J., 1999, 14, 5, 290-292, https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<290::AID-FFJ828>3.0.CO;2-4 . [all data]

Lota, Serra, et al., 1999
Lota, M.-L.; Serra, D.R.; Tomi, F.; Bessiere, J.-M.; Casanova, J., Chemical composition of peel and leaf essential oils of Citrus medica L. and C. limonimedica Lush., Flavour Fragr. J., 1999, 14, 3, 161-166, https://doi.org/10.1002/(SICI)1099-1026(199905/06)14:3<161::AID-FFJ801>3.0.CO;2-8 . [all data]

Mazzoni, Tomi, et al., 1999
Mazzoni, V.; Tomi, F.; Casanova, J., A daucane-type sesquiterpene from Faucus carota seed oil, Flavour Fragr. J., 1999, 14, 5, 268-272, https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<268::AID-FFJ823>3.0.CO;2-Z . [all data]

Sumathykutty, Rao, et al., 1999
Sumathykutty, M.A.; Rao, J.M.; Padmakumari, K.P.; Narayanan, C.S., Essential oil constituents of some Piper species, Flavour Fragr. J., 1999, 14, 5, 279-282, https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<279::AID-FFJ821>3.0.CO;2-0 . [all data]

Bicchi, Rubiolo, et al., 1998
Bicchi, C.; Rubiolo, P.; Marschall, H.; Weyerstahl, P.; Laurent, R., Constituents of Artemisia roxburghiana Besser essential oil, Flavour Fragr. J., 1998, 13, 1, 40-46, https://doi.org/10.1002/(SICI)1099-1026(199801/02)13:1<40::AID-FFJ688>3.0.CO;2-Z . [all data]

Isidorov, Zenkevich, et al., 1998
Isidorov, V.A.; Zenkevich, I.G.; Dubis, E.N.; Slowikowski, A.; Wojciuk, E., Group identification of essential oils components using partition coefficients in a hexane-acetonitrile system, J. Chromatogr. A, 1998, 814, 1-2, 253-260, https://doi.org/10.1016/S0021-9673(98)00398-7 . [all data]

Nogueira, Marsaioli, et al., 1998
Nogueira, P.C.L.; Marsaioli, A.J.; Amaral, M.C.E.; Bittrich, V., The fragrant floral oils of Tovomita species, Phytochemistry, 1998, 49, 4, 1009-1012, https://doi.org/10.1016/S0031-9422(97)01046-7 . [all data]

Mariotti, Costa, et al., 1997
Mariotti, J.P.; Costa, J.; Bianchini, A.; Bernardini, A.F.; Casanova, J., Composition and variability of the essential oil of Stachys glutinosa L. from Corsica (France), Flavour Fragr. J., 1997, 12, 3, 205-209, https://doi.org/10.1002/(SICI)1099-1026(199705)12:3<205::AID-FFJ636>3.0.CO;2-I . [all data]

Mariotti, Tomi, et al., 1997
Mariotti, J.P.; Tomi, F.; Casanova, J.; Costa, J.; Bernardini, A.F., Composition of the essential oil of Cistus Iadaniferus L. cultivated in corsica (France), Flavour Fragr. J., 1997, 12, 3, 147-151, https://doi.org/10.1002/(SICI)1099-1026(199705)12:3<147::AID-FFJ631>3.0.CO;2-Q . [all data]

Chung, Eiserich, et al., 1993
Chung, T.Y.; Eiserich, J.P.; Shibamoto, T., Volatile compounds isolated from edible Korean chamchwi (Aster scaber Thunb), J. Agric. Food Chem., 1993, 41, 10, 1693-1697, https://doi.org/10.1021/jf00034a033 . [all data]

De Pooter, Omar, et al., 1985
De Pooter, H.L.; Omar, M.N.; Coolsaet, B.A.; Schamp, N.M., The Essential Oil of Greater Galanga (Alpinia Galanga) from Malaysia, Phytochemistry, 1985, 24, 1, 93-96, https://doi.org/10.1016/S0031-9422(00)80814-6 . [all data]

Notes

Go To: Top, Van Den Dool and Kratz 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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