Linalool

Formula: C₁₀H₁₈O
Molecular weight: 154.2493
IUPAC Standard InChI: InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3
IUPAC Standard InChIKey: CDOSHBSSFJOMGT-UHFFFAOYSA-N
CAS Registry Number: 78-70-6
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:
- (S)-3,7-dimethyl-1,6-octadien-3-ol
Stereoisomers:
- (R)-linalool
Other names: 1,6-Octadien-3-ol, 3,7-dimethyl-; β-Linalool; Linalol; Linalyl alcohol; 2,6-Dimethyl-2,7-octadien-6-ol; allo-Ocimenol; 2,6-Dimethyl-2,7-octadiene-6-ol; 2,6-Dimethylocta-2,7-dien-6-ol; 3,7-Dimethyl-1,6-octadien-3-ol; 3,7-Dimethylocta-1,6-dien-3-ol; Linolool; Linanool; dl-3,7-Dimethyl-3-hydroxy-1,6-octadiene; Linalool ex bois de rose oil; Linalool ex ho oil; Linalool ex orange oil; Phantol; Linalool, β; (.+/-.)-Linalool; NSC 3789; beta-Linalool; p-Linalool; LINOLOOL (D); b-Linalool; Linaloyl oxide; (-)-linalool; 3,7-dimethyl-1,6-octandien-3-ol (linalool); R/S-linalool; ( S)-linalool; (+)-linalool; 3,7-dimethylocta-1,6-dien-3-ol (linalool); 3,7-dimethyl-1,6-octadien-3-ol (linalool); (-)-β-Linalool; (S)-Linalol; L-Linalool; (±)-linalool; 2,6-dimethyl-2,7-octadien-6-ol (linalool); linalool B; (+)-β-Linalool
Information on this page:
Other data available:
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Normal alkane RI, polar column, temperature ramp

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

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-Innowax	HP-Innowax	DB-FFAP	CP-Wax 52 CB	RTX-Wax
Column length (m)	60.	30.	30.	60.	60.
Carrier gas	Helium	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.32	0.25	0.22
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	50.	50.	40.	60.
T_end (C)	220.	250.	250.	220.	230.
Heat rate (K/min)	3.	5.	4.	3.	2.
Initial hold (min)	1.	5.	4.
Final hold (min)	5.	10.	5.		30.
I	1551.	1553.	1548.	1533.	1528.
Reference	Feng, Zhuang, et al., 2011	Menichini, Tundis, et al., 2011	Osorio, Carriazo, et al., 2011	Tsai, Huang, et al., 2011	Dib, Djabou, et al., 2010
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	VF-Wax MS	BP-20	TC-Wax	DB-Wax	DB-FFAP
Column length (m)	60.		60.	30.	30.
Carrier gas	Helium	Nitrogen	Helium	Helium
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.	40.	80.	0.
T_end (C)	220.	200.	230.	240.	200.
Heat rate (K/min)	3.	5.	3.	3.	6.
Initial hold (min)	5.		3.		2.
Final hold (min)	25.			2.
I	1541.	1550.	1550.	1556.	1540.
Reference	Duarte, Dias, et al., 2010	Mishra, Chaudhary, et al., 2010	Miyazawa, Fujita, et al., 2010	Vahirua-Lechat, Mitermite, et al., 2010	Laselan, Buettner, et al., 2009
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	TC-Wax	TC-WAX	RTX-Wax	BP-20	Innowax
Column length (m)	60.	60.	60.	50.	30.
Carrier gas	Helium	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.22	0.22	0.25
Phase thickness (μm)			0.25	0.25	0.25
T_start (C)	40.	40.	60.	60.	40.
T_end (C)	230.	230.	230.	220.	250.
Heat rate (K/min)	3.	3.	2.	2.	6.
Initial hold (min)		3.			1.
Final hold (min)			30.	20.	4.
I	1550.	1547.	1527.	1544.	1556.
Reference	Miyazawa, Nakanishi, et al., 2009	Miyazawa, Tomita, et al., 2009	Museli, Pau, et al., 2009	Ottavioli, Bighelli, et al., 2009	Seo, Kim, et al., 2009
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-Innowax	DB-Wax	HP-Innowax	DB-Wax	HP-FFAP
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	Nitrogen	Helium	Nitrogen	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.52	0.25	0.25	0.25	0.25
T_start (C)	35.	40.	50.	40.	40.
T_end (C)	205.	230.	280.	180.	120.
Heat rate (K/min)	3.	3.	5.	3.5	3.
Initial hold (min)	10.	2.	1.	10.	3.
Final hold (min)	10.	5.	1.	30.	5.
I	1553.	1546.	1547.	1561.	1564.
Reference	Wannes, Mhamdi, et al., 2009	Zhao, Xu, et al., 2009	Bousaada, Ammar, et al., 2008	Caldeira, de Sousa, et al., 2008	Guzman-Geronimo, Lopez, et al., 2008
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Innowax	DB-Wax	HP-Innowax	HP-Innowax	CP Wax 52 CB
Column length (m)	30.	30.	50.	30.	60.
Carrier gas		He	Helium	N2	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.20	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.20	0.25	0.25
T_start (C)	40.	30.	45.	50.	40.
T_end (C)	200.	210.	190.	240.	220.
Heat rate (K/min)	10.	5.	4.	5.	3.
Initial hold (min)	5.		2.	1.
Final hold (min)	15.		50.	4.
I	1553.	1550.	1549.	1542.	1542.
Reference	Kaypak and Avsar, 2008	Kumazawa, Itobe, et al., 2008	Soria, Sanz, et al., 2008	Cheraif, Ben Jannet, et al., 2007	Chen, Chyau, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CP-Wax 52CB	Carbowax	Carbowax	Carbowax 20M	TC-FFAP
Column length (m)	60.	60.	60.	25.
Carrier gas	He	He	He	Helium	He
Substrate
Column diameter (mm)	0.25	0.2	0.2	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.40	0.25
T_start (C)	40.	60.	60.	60.	60.
T_end (C)	220.	250.	250.	260.	220.
Heat rate (K/min)	3.	2.	2.	5.	3.
Initial hold (min)		8.	8.
Final hold (min)		15.	15.	40.	30.
I	1542.	1538.	1508.	1553.	1559.
Reference	Chyau, Tsai, et al., 2007	Ferhat, Meklati, et al., 2007	Ferhat, Tigrine-Kordjani, et al., 2007	Kafkas and Paydas, 2007	Kurose, Okamura, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	FFAP	DB-Wax	Supelcowax-10	BP-20	Carbowax
Column length (m)	30.	60.	30.	30.	60.
Carrier gas	N2	He	He	He	He
Substrate
Column diameter (mm)	0.32	0.32	0.2	0.25	0.25
Phase thickness (μm)	0.5	0.25	0.2	0.25	0.25
T_start (C)	35.	70.	70.	70.	40.
T_end (C)	320.	220.	220.	220.	180.
Heat rate (K/min)	4.	4.	3.	4.	5.
Initial hold (min)	5.			4.
Final hold (min)	45.		15.	5.
I	1568.	1549.	1544.	1559.	1509.
Reference	Nebesny, Budryn, et al., 2007	Pala-Paul, Brophy, et al., 2007	Pinto, Salgueiro, et al., 2007	Rawat, Gulati, et al., 2007	Singh, Kumar, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Supelcowax-10	Supelcowax-10	DB-Wax	DB-FFAP	Innowax
Column length (m)	30.	30.	60.	30.	30.
Carrier gas		He	He	He	N2
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)	40.	40.	60.	40.	50.
T_end (C)	250.	250.	180.	230.	280.
Heat rate (K/min)	2.	3.	3.	6.	9.
Initial hold (min)		5.	8.	1.	3.
Final hold (min)	33.	10.	80.		3.
I	1565.	1552.	1540.	1526.	1538.
Reference	Sylvestre, Pichette, et al., 2007	Vichi, Riu-Aumatell, et al., 2007	Wei A. and Shibamoto T., 2007	Zeller and Rychlik, 2007	Abdelwahed, Hayder, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Innowax	DB-Wax	AT-Wax	BP-20	DB-Wax
Column length (m)	30.	30.	60.	50.	60.
Carrier gas	N2	Helium	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	0.5
T_start (C)	50.	40.	60.	60.	50.
T_end (C)	280.	250.	200.	220.	230.
Heat rate (K/min)	9.	3.	4.	2.	3.
Initial hold (min)	3.				2.
Final hold (min)	3.	20.	20.	20.	20.
I	1547.	1530.	1509.	1543.	1549.
Reference	Abdelwahed, Hayder, et al., 2006	Berlinet, Brat, et al., 2006	Borges, Rojas, et al., 2006	Boti, Yao, et al., 2006	Cai, Lin, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Supelcowax 10	DB-Wax	DB-Wax	BP-20	BP-20
Column length (m)	30.	60.	60.	50.	50.
Carrier gas	Helium	He	N2	He	He
Substrate
Column diameter (mm)	0.20	0.25	0.25	0.22	0.22
Phase thickness (μm)	0.20	0.25	0.25	0.25	0.25
T_start (C)	70.	70.	70.	60.	60.
T_end (C)	220.	230.	230.	220.	220.
Heat rate (K/min)	3.	2.	2.	2.	2.
Initial hold (min)		2.	2.
Final hold (min)	15.	20.	20.	20.	20.
I	1543.	1553.	1553.	1544.	1544.
Reference	Cavaleiro, Pinto, et al., 2006	Choi H.S., 2006	Choi, 2006	Fanciullino, Tomi, et al., 2006	Fanciullino, Tomi, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-20M	Supelcowax-10	CP-Wax 52CB	DB-Wax Etr	DB-Wax
Column length (m)	50.	30.	30.	60.	15.
Carrier gas	He		He	He	He
Substrate
Column diameter (mm)	0.2	0.25	0.32	0.25	0.32
Phase thickness (μm)	0.1	0.25	0.25	0.25	0.25
T_start (C)	60.	40.	60.	40.	40.
T_end (C)	220.	210.	220.	230.	230.
Heat rate (K/min)	2.	2.	3.3	2.	6.
Initial hold (min)		2.	7.	5.
Final hold (min)	30.	33.	3.	100.	20.
I	1515.	1560.	1548.	1556.	1548.
Reference	Filippi, Lanfranchi, et al., 2006	Garneau F.X., Collin G., et al., 2006	Hymete, Rohloff, et al., 2006	Ibarz, Ferreira, et al., 2006	Kishimoto, Wanikawa, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	FFAP	HP-Innowax	DB-Wax	DB-Wax	DB-Wax
Column length (m)	20.	30.	60.	60.	25.
Carrier gas	He	He			He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.5	0.25	0.25	0.25
T_start (C)	90.	40.	70.	70.	100.
T_end (C)	250.	200.	230.	230.	250.
Heat rate (K/min)	6.	2.	2.	2.	8.
Initial hold (min)		3.	2.	2.
Final hold (min)		15.	20.	20.
I	1585.	1517.	1546.	1545.	1515.
Reference	Kitchlu, Bakshi, et al., 2006	Komes, Ulrich, et al., 2006	Lan Phi N.T., Nishiyama C., et al., 2006	Lan Phi N.T., Nishiyama C., et al., 2006	Lattoo, Dhar, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Supelcowax	HP-Wax	HP-20M	HP-20M	DB-Innowax
Column length (m)	30.	30.	30.	50.	60.
Carrier gas	N2	Nitrogen	N2	He	Helium
Substrate
Column diameter (mm)	0.32	0.25	0.25	0.2	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.2	0.25
T_start (C)	50.	50.	50.	70.	60.
T_end (C)	200.	280.	250.	180.	240.
Heat rate (K/min)	5.	5.	5.	4.	3.
Initial hold (min)				4.
Final hold (min)		5.	10.	15.	20.
I	1554.	1547.	1547.	1521.	1506.
Reference	Martin, Joseph, et al., 2006	Marzouk, Mansour, et al., 2006	Marzouk, Neffati, et al., 2006	Mastelic, Jerkovic, et al., 2006	Mendivil, Rodrigues, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	NB-20M	DB-Wax	Carbowax-PEG	Supelcowax-10	Supelcowax-10
Column length (m)	30.	60.	60.	30.	30.
Carrier gas	He		Helium	He	He
Substrate
Column diameter (mm)	0.2	0.25	0.20	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	50.	70.	60.	50.	50.
T_end (C)	250.	230.	250.	220.	250.
Heat rate (K/min)	2.	2.	2.	4.	4.
Initial hold (min)		2.	8.	1.	1.
Final hold (min)		20.	15.	10.	10.
I	1554.	1550.	1508.	1547.	1551.
Reference	Orav, Raal, et al., 2006	Sawamura, Onishi, et al., 2006	Tigrine-Kordiani, Meklati, et al., 2006	Wong, Lim, et al., 2006	Wong, Sivasothy, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Carbowax 20M	HP-20M	DB-Wax	HP-Innowax	Carbowax 20M
Column length (m)	60.	50.	30.	30.	50.
Carrier gas	N2	Helium	N2	He	Helium
Substrate
Column diameter (mm)	0.25	0.20	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.20	0.25	0.17	0.25
T_start (C)	40.	70.	60.	60.	40.
T_end (C)	190.	250.	250.	210.	190.
Heat rate (K/min)	10.	4.	5.	4.	4.
Initial hold (min)	2.	4.		3.	2.
Final hold (min)	15.	10.	10.	15.	30.
I	1544.	1507.	1537.	1555.	1535.
Reference	Babu and Kaul, 2005	Bezic, Skocibusic, et al., 2005	Fakhari A.R., Sonboli A., et al., 2005	Ferretti, Maggi, et al., 2005	de la Fuente, Martinez-Castro, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Supelcowax	Stabilwax	Stabilwax	Innowax	HP-20M
Column length (m)	60.	30.	30.	60.	50.
Carrier gas	He	H2		He	Helium
Substrate
Column diameter (mm)	0.2	0.32	0.32	0.25	0.20
Phase thickness (μm)	0.2	0.5	0.5	0.25	0.20
T_start (C)	60.	40.	40.	60.	70.
T_end (C)	230.	280.	280.	240.	180.
Heat rate (K/min)	4.	6.	6.	5.	4.
Initial hold (min)	30.	5.	5.		4.
Final hold (min)		5.	5.	30.	10.
I	1500.	1522.	1502.	1550.	1507.
Reference	Gauvin and Smadja, 2005	Jirovetz, Buchbauer, et al., 2005	Jirovetz, Buchbauer, et al., 2005, 2	Joichi, Yomogida, et al., 2005	Kulisic, Radonic, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-20M	DB-Wax	DB-Wax	DB-Wax	DB-Wax
Column length (m)	50.	30.	30.	60.	60.
Carrier gas	Helium	He	He	N2	N2
Substrate
Column diameter (mm)	0.20	0.25	0.25	0.25	0.25
Phase thickness (μm)	0.20	0.25	0.25	0.25	0.25
T_start (C)	70.	40.	50.	70.	70.
T_end (C)	180.	210.	180.	230.	230.
Heat rate (K/min)	4.	5.	3.	2.	2.
Initial hold (min)	4.			2.	2.
Final hold (min)	10.		40.	20.	20.
I	1507.	1550.	1550.	1558.	1558.
Reference	Kulisic, Radonic, et al., 2005	Kumazawa, Kubota, et al., 2005	Lee, Umano, et al., 2005	Njoroge, Koaze, et al., 2005	Njoroge, Koaze, et al., 2005, 2
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	PE-Wax	CP-Wax 52CB	CP-Wax 52CB
Column length (m)	60.	60.	50.	30.	30.
Carrier gas	He	Nitrogen	H2	He	He
Substrate
Column diameter (mm)	0.32	0.32	0.32	0.32	0.32
Phase thickness (μm)	0.25	0.50	0.25	0.25	0.25
T_start (C)	35.	35.	60.	40.	40.
T_end (C)	220.	235.	220.	220.	220.
Heat rate (K/min)	3.	2.	4.	4.	4.
Initial hold (min)		4.		1.	1.
Final hold (min)		30.	2.
I	1549.	1562.	1550.	1549.	1549.
Reference	Palá-Paúl, Pérez-Alonso, et al., 2005	Qian and Wang, 2005	Ram, Kumar, et al., 2005	Rohloff and Bones, 2005	Rohloff and Bones, 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	Supelcowax-10	Supelcowax-10	Supelcowax-10	Supelcowax-10
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	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	40.	40.	40.	50.	50.
T_end (C)	250.	210.	220.	220.	220.
Heat rate (K/min)	4.	2.	3.	4.	4.
Initial hold (min)		2.	5.	3.	3.
Final hold (min)	10.	33.	10.	30.	30.
I	1562.	1570.	1552.	1544.	1553.
Reference	Salehi, Sonboli, et al., 2005	Stevanovic, Garneau, et al., 2005	Vichi, Riu-Aumatell, et al., 2005	Wong, Lee, et al., 2005	Wong and Tan, 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	ZB-Wax	ZB-Wax	ZB-Wax	DB-Wax	ZB-Wax
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	Helium	Helium	He	H2	He
Substrate
Column diameter (mm)	0.32	0.32	0.32	0.32	0.32
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	40.	40.	40.	40.	40.
T_end (C)	250.	250.	250.	230.	250.
Heat rate (K/min)	5.	5.	5.	5.	5.
Initial hold (min)	2.	2.	2.	2.	2.
Final hold (min)	5.	5.	10.	15.	10.
I	1528.	1536.	1536.	1528.	1536.
Reference	N/A	N/A	Wu, Krings, et al., 2005	Wu, Krings, et al., 2005	Wu, Krings, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	PEG-20M	DB-Wax	BP-20	DB-Wax	DB-Wax
Column length (m)	30.	30.	50.	60.	60.
Carrier gas		He			N2
Substrate
Column diameter (mm)	0.25	0.25	0.22	0.25	0.25
Phase thickness (μm)		0.25	0.25	0.5	0.25
T_start (C)	60.	90.	60.	35.	70.
T_end (C)	180.	220.	220.	240.	230.
Heat rate (K/min)	3.	7.	2.	4.	2.
Initial hold (min)	10.	2.		5.	2.
Final hold (min)	30.	5.	20.	10.	20.
I	1551.	1584.	1535.	1565.	1557.
Reference	Yao, Guo, et al., 2005	Agnihotri, Thappa, et al., 2004	Blanc, Muselli, et al., 2004	Chida, Sone, et al., 2004	Choi, 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	Supelcowax-10	DB-Wax	DB-Wax
Column length (m)	60.	30.	60.	60.	60.
Carrier gas	N2	H2	He	He	He
Substrate
Column diameter (mm)	0.25	0.32	0.2	0.25	0.25
Phase thickness (μm)	0.25	0.5	0.2
T_start (C)	70.	40.	60.	60.	60.
T_end (C)	230.	200.	200.	220.	220.
Heat rate (K/min)	2.	4.	4.	2.	2.
Initial hold (min)	2.	5.		4.	4.
Final hold (min)	20.		40.
I	1558.	1570.	1506.	1546.	1546.
Reference	Choi, 2004, 2	Culleré, Escudero, et al., 2004	Gauvin, Ravaomanarivo, et al., 2004	Jiang and Kubota, 2004	Jiang and Kubota, 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	Innowax FSC	BP-20	PEG-20M	PEG-20M
Column length (m)	60.	60.	25.	50.	50.
Carrier gas	He	Helium	N2
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.20	0.20
Phase thickness (μm)	0.25		0.25	0.20	0.20
T_start (C)	40.	60.	60.	40.	40.
T_end (C)	220.	220.	220.	180.	180.
Heat rate (K/min)	3.	4.	5.	3.	3.
Initial hold (min)	5.	10.		5.	5.
Final hold (min)				30.	30.
I	1565.	1553.	1546.	1532.	1542.
Reference	López, Ezpeleta, et al., 2004	Lourens, Reddy, et al., 2004	Mallavarapu, Kulkarni, et al., 2004	Narain, Almeida, et al., 2004	Narain, Almeida, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Supelcowax-10	Supelcowax-10	DB-Wax	NB-20M	SW-10
Column length (m)	50.	50.	60.	50.	50.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.2	0.2	0.32	0.2	0.20
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	70.	70.	35.	50.	50.
T_end (C)	230.	230.	220.	250.	230.
Heat rate (K/min)	2.	2.	3.	2.	2.
Initial hold (min)
Final hold (min)
I	1545.	1547.	1551.	1551.	1546.
Reference	Orav, Stulova, et al., 2004	Orav, Stulova, et al., 2004	Palá-Paúl, Brophy, et al., 2004	Raal, Arak, et al., 2004	Raal, Paaver, et al., 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	HP-Innowax	Carbowax 20M	DB-Wax
Column length (m)	60.	60.	50.	25.	60.
Carrier gas		Nitrogen	He	N2	H2
Substrate
Column diameter (mm)	0.25	0.25	0.2	0.22	0.32
Phase thickness (μm)	0.25	0.25	0.2	0.25	0.25
T_start (C)	70.	70.	45.	50.	40.
T_end (C)	230.	230.	190.	200.	230.
Heat rate (K/min)	2.	2.	4.	5.	4.
Initial hold (min)	2.	2.	2.		5.
Final hold (min)	20.		50.		25.
I	1563.	1563.	1548.	1549.	1548.
Reference	Sawamura, Son, et al., 2004	Sawamura, Sou, et al., 2004	Soria, Gonzalez, et al., 2004	Agnaniet, Mounzeo, et al., 2003	Dregus and Engel, 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-20M	DB-Wax	DB-Wax	HP-20M	TC-Wax
Column length (m)	50.	30.	30.	50.	60.
Carrier gas	He	He	H2	He	He
Substrate
Column diameter (mm)	0.2	0.25	0.32	0.2	0.25
Phase thickness (μm)	0.2	0.25	0.5	0.2
T_start (C)	70.	40.	40.	70.	80.
T_end (C)	180.	185.	200.	180.	240.
Heat rate (K/min)	4.	4.	4.	4.	3.
Initial hold (min)	4.	4.	5.	4.
Final hold (min)	10.	20.		10.
I	1514.	1544.	1571.	1507.	1544.
Reference	Juteau, Jerkovic, et al., 2003	Lee and Noble, 2003	López, Ortín, et al., 2003	Mastelic and Jerkovic, 2003	Miyazawa, Teranishi, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	PEG 20M	Carbowax 20M	SW-10	Carbowax 20M
Column length (m)	60.		50.	50.	50.
Carrier gas	Helium		N2	He	Helium
Substrate
Column diameter (mm)	0.25		0.25	0.20	0.70
Phase thickness (μm)			0.25	0.25
T_start (C)	70.	70.	90.	50.	50.
T_end (C)	210.	180.	220.	250.	280.
Heat rate (K/min)	2.	5.	3.	2.	4.
Initial hold (min)		2.			2.
Final hold (min)	60.
I	1545.	1537.	1557.	1545.	1518.
Reference	Mookdasanit, Tamura, et al., 2003	Nakahara, Alzoreky, et al., 2003	Priestap, van Baren, et al., 2003	Raal, Arak, et al., 2003	Saura, LAencina, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Carbowax 20M	HP-Innowax	HP-Innowax	Innowax	DB-Wax
Column length (m)	50.	50.	50.	60.	60.
Carrier gas	He			He	N2
Substrate
Column diameter (mm)	0.25	0.2	0.2	0.25	0.25
Phase thickness (μm)	0.25	0.2	0.2		0.25
T_start (C)	45.	50.	50.	60.	70.
T_end (C)	190.	220.	220.	220.	230.
Heat rate (K/min)	4.	4.	4.	4.	2.
Initial hold (min)	2.	5.	5.	10.	2.
Final hold (min)	50.			10.	20.
I	1539.	1508.	1508.	1553.	1533.
Reference	Soria, Martinez-Castro, et al., 2003	Stashenko, Jaramillo, et al., 2003	Stashenko, Jaramillo, et al., 2003	Suleimenov, Atazharova, et al., 2003	Tu, Onishi, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	DB-Wax	RTX-Wax	DB-Wax
Column length (m)	60.	30.	30.	60.	60.
Carrier gas	N2	H2	He	He	H2
Substrate
Column diameter (mm)	0.25	0.32	0.25	0.25	0.32
Phase thickness (μm)	0.25	0.5	0.25	0.5	0.25
T_start (C)	70.	40.	40.	40.	40.
T_end (C)	230.	200.	250.	180.	245.
Heat rate (K/min)	2.	4.	8.	5.	1.5
Initial hold (min)	2.	5.	5.	5.
Final hold (min)	20.		5.	20.	20.
I	1536.	1567.	1552.	1545.	1545.
Reference	Tu, Onishi, et al., 2003, 2	Ferreira, Ortín, et al., 2002	Fu, Yoon, et al., 2002	Galindo-Cuspinera, Lubran, et al., 2002	Gancel, Ollé, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	Carbowax 20M	DB-Wax	DB-Wax	DB-Wax
Column length (m)	60.	30.	30.	60.	30.
Carrier gas		He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.32
Phase thickness (μm)		0.325	0.25	0.25	0.5
T_start (C)	60.	50.	40.	40.	40.
T_end (C)	180.	215.	210.	210.	240.
Heat rate (K/min)	3.	4.	5.	5.	7.
Initial hold (min)	4.
Final hold (min)		20.			5.
I	1552.	1506.	1550.	1549.	1555.
Reference	Ito, Sugimoto, et al., 2002	Kasali, Winterhalter, et al., 2002	Kumazawa and Masuda, 2002	Kumazawa and Masuda, 2002	Lin, Rouseff, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Supelcowax-10	Supelcowax-10	DB-Wax	DB-Wax	DB-Wax
Column length (m)	60.	60.	60.	60.	60.
Carrier gas	He	He	N2	N2	He
Substrate
Column diameter (mm)	0.2	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.5	0.5	0.25	0.25	0.25
T_start (C)	70.	70.	70.	70.	40.
T_end (C)	220.	220.	230.	230.	200.
Heat rate (K/min)	2.	2.	2.	2.	2.
Initial hold (min)			2.		2.
Final hold (min)			20.
I	1560.	1547.	1542.	1552.	1539.
Reference	Orav, Kailas, et al., 2002	Orav, Kailas, et al., 2002	Tu, Onishi, et al., 2002	Tu, Thanh, et al., 2002	Umano, Hagi, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	EC-1000	DB-Wax	FFAP	DB-Wax
Column length (m)	30.	30.	60.	30.	30.
Carrier gas	H2	He	He	H2	H2
Substrate
Column diameter (mm)	0.32	0.25	0.25	0.32	0.32
Phase thickness (μm)	0.5	0.25	0.25	0.25	0.5
T_start (C)	40.	35.	45.	40.	40.
T_end (C)	200.	230.	240.	240.	200.
Heat rate (K/min)	4.	5.	3.	3.	4.
Initial hold (min)	5.	5.		5.	5.
Final hold (min)	60.	15.			60.
I	1565.	1560.	1548.	1552.	1565.
Reference	Aznar, López, et al., 2001	Bendall, 2001	Christoph, 2001	Ducruet, Fournier, et al., 2001	Ferreira, Aznar, et al., 2001
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	Stabilwax	Carbowax 20M	DB-Wax
Column length (m)	60.	60.	30.	30.	30.
Carrier gas	He	He	H2	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.32	0.25	0.25
Phase thickness (μm)			0.25	0.25	0.1
T_start (C)	60.	40.	60.	50.	40.
T_end (C)	220.	220.	280.	215.	180.
Heat rate (K/min)	2.	2.	10.	4.	2.
Initial hold (min)	4.		5.		5.
Final hold (min)			5.		20.
I	1583.	1559.	1519.	1506.	1554.
Reference	Jiang, Kojima, et al., 2001	Jiang and Kubota, 2001	Jirovetz L., Buchbauer G., et al., 2001	Kasali, Oyedeji, et al., 2001	Kato and Shibamoto, 2001
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	BP-20	TC-Wax	PEG-20M	PEG-20M	DB-FFAP
Column length (m)	50.	60.	50.	50.	30.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.22	0.25	0.2	0.2	0.32
Phase thickness (μm)	0.25				0.25
T_start (C)	60.	80.	70.	70.	40.
T_end (C)	230.	250.	220.	220.	195.
Heat rate (K/min)	2.	4.	2.	2.	5.
Initial hold (min)					5.
Final hold (min)	35.	47.			40.
I	1539.	1550.	1547.	1547.	1522.
Reference	Lota, de Rocca Serra, et al., 2001	Miyazawa, Kurose, et al., 2001	Orav and Kann, 2001	Orav and Kann, 2001	Suriyaphan, Drake, et al., 2001
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Carbowax 20M	DB-Wax	Innowax	DB-Wax	CP-Wax 52CB
Column length (m)	50.	30.	60.	60.	50.
Carrier gas	He	He	He		He
Substrate
Column diameter (mm)	0.22	0.25	0.25	0.25	0.30
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	50.	60.	30.	40.
T_end (C)	220.	220.	220.	170.	220.
Heat rate (K/min)	2.	4.	4.	2.	3.
Initial hold (min)		3.	10.	4.	5.
Final hold (min)			10.	30.
I	1560.	1554.	1553.	1546.	1557.
Reference	Vernin, Lageot, et al., 2001	Weckerle, Bastl-Borrmann, et al., 2001	Baser, Özek, et al., 2000	Buttery, Light, et al., 2000	Chagonda, Makanda, et al., 2000
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CP-Wax 52CB	FFAP	DB-Wax	Supelcowax-10	Supelcowax-10
Column length (m)	50.	30.	30.	30.	60.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.30	0.32	0.2	0.32	0.25
Phase thickness (μm)	0.25	0.25		0.25	0.25
T_start (C)	40.	40.	50.	70.	60.
T_end (C)	220.	230.	180.	240.	280.
Heat rate (K/min)	3.	6.	3.	5.	4.
Initial hold (min)	5.	2.	8.	8.
Final hold (min)		5.		20.
I	1557.	1543.	1579.	1534.	1553.
Reference	Chagonda, Makanda, et al., 2000	Czerny and Grosch, 2000	Franco and Shibamoto, 2000	Kim, Kim, et al., 2000	Korány, Mednyánszky, et al., 2000
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	BP-20	DB-Wax	DB-Wax	DB-Wax
Column length (m)	30.	25.	25.	25.	60.
Carrier gas	H2	Nitrogen	He	He	Nitrogen
Substrate
Column diameter (mm)	0.32	0.50	0.25	0.25	0.25
Phase thickness (μm)	0.5	0.25	0.25	0.25
T_start (C)	60.	60.	50.	50.	40.
T_end (C)	245.	200.	200.	200.	200.
Heat rate (K/min)	3.	5.	4.	4.	2.
Initial hold (min)	3.		4.	4.	10.
Final hold (min)	20.		10.	10.
I	1555.	1550.	1544.	1544.	1553.
Reference	Kotseridis and Baumes, 2000	Mallavarapu, Rao, et al., 2000	Morales, Duque, et al., 2000	Morales, Duque, et al., 2000	Tamura, Boonbumrung, et al., 2000
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	FFAP	CW 20M	CW 20M	CW 20M	CW 20M
Column length (m)	25.	25.	25.	25.	25.
Carrier gas	N2	Hydrogen	Hydrogen	Hydrogen	Hydrogen
Substrate
Column diameter (mm)	0.25	0.32	0.32	0.32	0.32
Phase thickness (μm)		0.25	0.25	0.25	0.25
T_start (C)	70.	50.	50.	50.	50.
T_end (C)	210.	220.	220.	220.	220.
Heat rate (K/min)	3.	3.	3.	3.	3.
Initial hold (min)	5.	1.	1.	1.	1.
Final hold (min)		10.	10.	10.	10.
I	1522.	1552.	1552.	1553.	1553.
Reference	Ajaiyeoba and Ekundayo, 1999	Bicchi, Binello, et al., 1999	Bicchi, Binello, et al., 1999	Bicchi, Binello, et al., 1999	Bicchi, Binello, et al., 1999
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CW 20M	Supelcowax-10	BP-20	PEG-20M	DB-Wax
Column length (m)	25.	30.	25.	60.	30.
Carrier gas	Hydrogen			N2
Substrate
Column diameter (mm)	0.32	0.25	0.33	0.25	0.53
Phase thickness (μm)	0.25	0.25	0.5
T_start (C)	50.	60.	80.	70.	60.
T_end (C)	220.	220.	220.	220.	210.
Heat rate (K/min)	3.	4.	5.	3.	4.
Initial hold (min)	1.
Final hold (min)	10.
I	1553.	1539.	1564.	1550.	1551.
Reference	Bicchi, Binello, et al., 1999	Choo, Wong, et al., 1999	Dunlop, Bignell, et al., 1999	Hirose, Joichi, et al., 1999	Iwatsuki, Mizota, et al., 1999
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	HP Innowax FSP	Innowax	HP-Innowax	HP-Innowax
Column length (m)	30.	60.	60.	60.	60.
Carrier gas		He	He	He	He
Substrate
Column diameter (mm)	0.53	0.25	0.25	0.25	0.25
Phase thickness (μm)		0.25	0.25	0.25	0.25
T_start (C)	60.	60.	60.	60.	60.
T_end (C)	210.	220.	220.	220.	220.
Heat rate (K/min)	4.
Initial hold (min)		10.	10.	10.	10.
Final hold (min)		10.
I	1554.	1553.	1553.	1553.	1553.
Reference	Iwatsuki, Mizota, et al., 1999	Kaya, Baser, et al., 1999	Kaya, Baser, et al., 1999, 2	Kaya, Baser, et al., 1999, 3	Kaya, Baser, et al., 1999, 3
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	Carbowax 20M	Carbowax	FFAP
Column length (m)	30.	60.	60.	50.	25.
Carrier gas			He	N2	He
Substrate
Column diameter (mm)	0.53	0.25	0.32	0.2	0.2
Phase thickness (μm)	1.	0.25	0.5
T_start (C)	40.	40.	40.	80.	70.
T_end (C)	210.	210.	190.	200.	210.
Heat rate (K/min)	5.	5.	2.	1.	3.
Initial hold (min)			5.		10.
Final hold (min)				20.
I	1550.	1550.	1551.	1501.	1548.
Reference	Kumazawa and Masuda, 1999	Kumazawa and Masuda, 1999	Lopez, Ferreira, et al., 1999	Menon, Chacko, et al., 1999	Mockute and Bernotiene, 1999
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	HP-Innowax	BP-20	DB-Wax	BP-20
Column length (m)	60.	25.	25.	60.	25.
Carrier gas	He		N2	N2	H2
Substrate
Column diameter (mm)	0.25	0.25	0.5		0.33
Phase thickness (μm)	0.25			0.25	0.5
T_start (C)	60.	35.	60.	60.	80.
T_end (C)	240.	250.	200.	220.	220.
Heat rate (K/min)	4.	4.	5.	5.	5.
Initial hold (min)
Final hold (min)
I	1540.	1548.	1550.	1554.	1564.
Reference	Ngassoum, Yonkeu, et al., 1999	Ong and Acree, 1999	Rao, Bhattacharya, et al., 1999	Weyerstahl, Marschall, et al., 1999	Bignell, Dunlop, et al., 1998
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CP-Wax 52CB	Carbowax 20M	Carbowax 20M	Carbowax 20M	Supelcowax-10
Column length (m)	25.	60.	60.	60.	30.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.32	0.32	0.32	0.32	0.25
Phase thickness (μm)	0.2	0.5	0.5	0.5
T_start (C)	60.	40.	40.	40.	60.
T_end (C)	240.	190.	190.	190.	240.
Heat rate (K/min)	6.	2.	2.	2.	4.
Initial hold (min)	2.	5.	5.	5.
Final hold (min)	10.
I	1542.	1551.	1551.	1551.	1554.
Reference	Chisowa, Hall, et al., 1998	Ferreira, Ardanuy, et al., 1998	Ferreira, Ardanuy, et al., 1998	Ferreira, Lopez, et al., 1998	Lamarque, Maestri, et al., 1998
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	HP-Innowax	CBP-20	DB-Wax
Column length (m)	30.	30.	25.	25.	60.
Carrier gas	N2	N2
Substrate
Column diameter (mm)	0.25	0.25	0.32	0.25	0.25
Phase thickness (μm)	0.25	0.25			0.25
T_start (C)	45.	45.	35.	35.	50.
T_end (C)	220.	220.	250.	200.	230.
Heat rate (K/min)	3.	3.	4.	5.	2.
Initial hold (min)				5.
Final hold (min)
I	1568.	1557.	1548.	1536.	1545.
Reference	Molleken U., Sinnwell V., et al., 1998	Mölleken, Sinnwell, et al., 1998	Ong and Acree, 1998	Quiroz A. and Niemeyer H.M., 1998	Ravichandran and Parthiban, 1998
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-Innowax	HP-Innowax FSC	PEG-20M	PEG-20M	HP-Innowax FSC
Column length (m)	60.	60.	60.	60.	60.
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
T_start (C)	50.	60.	70.	70.	60.
T_end (C)	220.	220.	210.	220.	240.
Heat rate (K/min)	5.	4.	3.	3.	4.
Initial hold (min)	5.	10.			10.
Final hold (min)		10.			10.
I	1556.	1553.	1546.	1546.	1553.
Reference	Stashenko, Cervantes, et al., 1998	Tümen, Baser, et al., 1998	Awano, Honda, et al., 1997	Awano, Ichikawa, et al., 1997	Baser, Kirimer, et al., 1997
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	BP-20	BP-20	BP-20	BP-20	BP-20
Column length (m)	25.	25.	25.	25.	25.
Carrier gas	H2	H2	H2	H2
Substrate
Column diameter (mm)	0.33	0.33	0.33	0.33	0.33
Phase thickness (μm)	0.5	0.5	0.5	0.5	0.5
T_start (C)	80.	80.	80.	80.	80.
T_end (C)	220.	220.	220.	220.	220.
Heat rate (K/min)	5.	5.	5.	5.	5.
Initial hold (min)
Final hold (min)
I	1564.	1564.	1564.	1564.	1564.
Reference	Bignell, Dunlop, et al., 1997	Bignell, Dunlop, et al., 1997, 2	Bignell, Dunlop, et al., 1997, 3	Bignell, Dunlop, et al., 1997, 4	Bignell, Dunlop, et al., 1997, 5
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	BP-20	DB-Wax	HP-Innowax	Supelcowax-10	Supelcowax-10
Column length (m)	25.	30.	60.	30.	0.
Carrier gas	H2	H2	H2		He
Substrate
Column diameter (mm)	0.33	0.32	0.32	0.25	0.25
Phase thickness (μm)	0.5	0.5	0.5
T_start (C)	80.	40.	50.	60.	40.
T_end (C)	220.	220.	180.	240.	240.
Heat rate (K/min)	5.	4.	1.5	4.	3.
Initial hold (min)
Final hold (min)
I	1564.	1563.	1573.	1554.	1554.
Reference	Bignell, Dunlop, et al., 1997, 6	Lebossé, Ducruet, et al., 1997	Ulrich, Hoberg, et al., 1997	Zunino, Novillo-Newton, et al., 1997	Zygadlo, Ariza-Espinar, et al., 1997
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	PEG-20M	DB-Wax	TC-Wax	Supelcowax-10
Column length (m)	30.	50.	60.	60.	60.
Carrier gas	N2	He	He		He
Substrate
Column diameter (mm)	0.319	0.25	0.32	0.25	0.25
Phase thickness (μm)	0.25		0.50		0.25
T_start (C)	60.	70.	50.	80.	40.
T_end (C)	300.	250.	250.	240.	200.
Heat rate (K/min)	8.	2.	8.	3.	3.
Initial hold (min)			1.	5.	3.
Final hold (min)	15.		6.		30.
I	1556.	1546.	1513.	1546.	1554.
Reference	Malizia, Molli, et al., 1996	Orav, Kailas, et al., 1996	Sagrero-Nieves and Bartley, 1996	Shuichi, Masazumi, et al., 1996	Wong and Lai, 1996
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Carbowax 20M	DB-Wax	Carbowax 20M	PEG-20M	PEG-20M
Column length (m)	60.	60.	60.	50.	50.
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	0.15	0.15
T_start (C)	60.	50.	50.	60.	60.
T_end (C)	180.	180.	150.	180.	180.
Heat rate (K/min)	2.	2.5	2.	2.	2.
Initial hold (min)	4.	5.	10.	4.	4.
Final hold (min)			20.
I	1522.	1517.	1553.	1522.	1523.
Reference	Kawakami, Ganguly, et al., 1995	Stashenko, Torres, et al., 1995	Tirado, Stashenko, et al., 1995	Togari, Kobayashi, et al., 1995	Togari, Kobayashi, et al., 1995
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	Supelcowax-10	Carbowax 20M	Carbowax 20M	DB-Wax
Column length (m)	60.		80.	50.	60.
Carrier gas				He	He
Substrate
Column diameter (mm)	0.32		0.2	0.25	0.25
Phase thickness (μm)	0.5				0.25
T_start (C)	50.	40.	70.	60.	50.
T_end (C)	225.	210.	170.	180.	230.
Heat rate (K/min)	2.	2.	2.	2.	2.
Initial hold (min)		2.		4.	4.
Final hold (min)		120.
I	1573.	1552.	1506.	1522.	1546.
Reference	Sagrero-Nieves, Bartley, et al., 1994	Collin, Deslauriers, et al., 1993	Egolf and Jurs, 1993	Kawakami, Kobayashi, et al., 1993	Shimoda, Shiratsuchi, et al., 1993
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	Carbowax 20M	Carbowax 20M	Supelcowax-10	DB-Wax
Column length (m)	30.	45.	50.	60.	30.
Carrier gas	He	Hydrogen	He	He
Substrate
Column diameter (mm)	0.25	0.32	0.25	0.32	0.32
Phase thickness (μm)		1.0
T_start (C)	60.	60.	60.	60.	70.
T_end (C)	240.	200.	180.	220.	200.
Heat rate (K/min)	3.	2.	2.	2.	4.
Initial hold (min)	10.	5.	4.	1.	2.
Final hold (min)
I	1505.	1553.	1522.	1564.	1560.
Reference	Hatsuko, Kazuko, et al., 1992	Kollmannsberger, Nitz, et al., 1992	Kawakami and Kobayashi, 1991	Loughrin, Hamilton-Kemp, et al., 1990	Wyllie, Brophy, et al., 1990
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-Wax	FFAP	Supelcowax-10	DB-Wax
Column length (m)	60.	60.	50.	60.	60.
Carrier gas				He	He
Substrate
Column diameter (mm)	0.32	0.32		0.32	0.322
Phase thickness (μm)					0.25
T_start (C)	50.	50.	50.	60.	50.
T_end (C)	230.	250.	180.	220.	230.
Heat rate (K/min)	4.	4.	10.	2.	4.
Initial hold (min)	0.1	0.1	1.	1.
Final hold (min)	10.	5.		30.
I	1542.	1541.	1570.	1560.	1545.
Reference	Binder, Flath, et al., 1989	Binder and Flath, 1989	Brophy, Davies, et al., 1989	Andersen, Hamilton-Kemp, et al., 1988	Engel, Flath, et al., 1988
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Supelcowax-10	DB-Wax	DB-Wax	Carbowax 20M	Carbowax 20M
Column length (m)	60.	60.	60.	150.	25.
Carrier gas		H2	H2
Substrate
Column diameter (mm)	0.32	0.25	0.25	0.66	0.30
Phase thickness (μm)		0.25	0.25
T_start (C)	60.	30.	30.	60.	40.
T_end (C)	220.	180.	180.	170.	220.
Heat rate (K/min)	3.	2.	2.	1.	2.
Initial hold (min)	1.	2.	2.	40.	5.
Final hold (min)
I	1556.	1551.	1551.	1545.	1550.
Reference	Hamilton-Kemp, Andersen, et al., 1988	Takeoka, Flath, et al., 1988	Takeoka, Flath, et al., 1988	Buttery, Ling, et al., 1987	Nykanen, 1986
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Packed
Active phase	Carbowax 20M	Carbowax 20M	Carbowax 20M	Carbowax 20M	Carbowax 20M
Column length (m)	150.	150.	50.	150.	2.
Carrier gas					Hydrogen
Substrate					Gas-Chrom Z (80-100 mesh)
Column diameter (mm)	0.66	0.66	0.32	0.64
Phase thickness (μm)
T_start (C)	60.	60.	70.	50.	65.
T_end (C)	170.	170.	180.	170.	220.
Heat rate (K/min)	1.	1.	2.	1.	4.
Initial hold (min)	40.	40.		30.
Final hold (min)
I	1545.	1545.	1526.	1545.	1532.
Reference	Buttery, Xu, et al., 1985	Buttery and Ling, 1984	Engel and Tressl, 1983	Buttery and Kamm, 1980	Stancher and Pertoldi, 1967
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

References

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

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Czerny and Grosch, 2000
Czerny, M.; Grosch, W., Potent odorants of raw Arabica coffee. Their changes during roasting, J. Agric. Food Chem., 2000, 48, 3, 868-872, https://doi.org/10.1021/jf990609n . [all data]

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Franco, M.R.B.; Shibamoto, T., Volatile composition of some Brazilian fruits: umbu-caja (Spondias citherea), camu-camu (Myrciaria dubia), araca-boi (Eugenia stipitata), and cupuacu (Theobroma grandiflorum), J. Agric. Food Chem., 2000, 48, 4, 1263-1265, https://doi.org/10.1021/jf9900074 . [all data]

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Kumazawa, K.; Masuda, H., Identification of potent odorants in Japanese green tea (Sen-cha), J. Agric. Food Chem., 1999, 47, 12, 5169-5172, https://doi.org/10.1021/jf9906782 . [all data]

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Mockute, D.; Bernotiene, G., The main citral-geraniol and carvacrol chemotypes of the essential oil of Thymus pulegioides L. growing wild in Vilnius district (Lithuania), J. Agric. Food Chem., 1999, 47, 9, 3787-3790, https://doi.org/10.1021/jf980987c . [all data]

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Ong and Acree, 1999
Ong, P.K.C.; Acree, T.E., Similarities in the aroma chemistry of Gewürztraminer variety wines and lychee (Litchi chinesis Sonn.) fruit, J. Agric. Food Chem., 1999, 47, 2, 665-670, https://doi.org/10.1021/jf980452j . [all data]

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Notes

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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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