Geranyl acetate

Formula: C₁₂H₂₀O₂
Molecular weight: 196.2860
IUPAC Standard InChI: InChI=1S/C12H20O2/c1-10(2)6-5-7-11(3)8-9-14-12(4)13/h6,8H,5,7,9H2,1-4H3/b11-8+
IUPAC Standard InChIKey: HIGQPQRQIQDZMP-DHZHZOJOSA-N
CAS Registry Number: 105-87-3
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:
- Acetic acid, geranyl ester
Stereoisomers:
- 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (Z)-
- 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate
Other names: 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (E)-; Acetic acid, geraniol ester; Bay pine (oyster) oil; Geraniol acetate; trans-3,7-Dimethyl-2,6-octadien-1-ol, acetate; NCI-C54728; 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, trans-; 3,7-Dimethyl-2-trans, 6-octadienyl acetate; trans-3,7-Dimethyl-2,6-octadien-1-yl acetate; trans-2,6-Dimethyl-2,6-octadien-8-yl ethanoate; Geranyl ethanoate; (E)-3,7-Dimethyl-2,6-octadien-1-yl acetate; Meraneine; trans-Geranyl acetate; 2,6-Octadien-1-ol, 3,7-dimethyl-, 1-acetate, (2E)-; 2,6-Octadien-1-ol, 3,7-dimethyl-, acetate, (2E)-; NSC 2584; (2E)-3,7-Dimethyl-2,6-octadienyl acetate; (E)-3,7-Dimethyl-2,6-octadien-1-ol acetate
Information on this page:
Other data available:
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Normal alkane RI, non-polar column, temperature ramp

Go To: Top, References, Notes

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

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5	RTX-5 MS	HP-5 MS	RTX-1	RTX-1
Column length (m)	30.	30.	60.	60.	60.
Carrier gas	Helium	Helium	Helium	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.22	0.22
Phase thickness (μm)	0.25		0.25	0.25	0.25
T_start (C)	60.	60.	40.	60.	60.
T_end (C)	300.	240.	250.	230.	230.
Heat rate (K/min)	4.	3.	3.	2.	2.
Initial hold (min)	3.		1.
Final hold (min)	15.		20.	5.	5.
I	1383.	1383.	1396.	1362.	1362.
Reference	Bertuzzi, Tirillini, et al., 2013	Pinheiro, de Queiros, et al., 2013	Sardashti, Valizadeh, et al., 2013	Bendiabdellah, El Amine Dib, et al., 2012	Bendiabdellah, El Amine Dib, et al., 2012
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DP-5	DP-5	HP-1	SE-30 MS	DB-1
Column length (m)	30.	30.	30.	30.	50.
Carrier gas	Helium	Helium	Helium	Helium	Helium
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	0.25
T_start (C)	80.	80.	60.	50.	60.
T_end (C)	300.	300.	240.	250.	250.
Heat rate (K/min)	4.	4.	3.	5.	8.
Initial hold (min)	1.	1.		5.
Final hold (min)	40.	40.		10.
I	1352.	1352.	1381.	1388.	1364.
Reference	Vijayakumar, Duraipandiyan, et al., 2012	Vijayakumar, Duraipandiyan, et al., 2012	Alizadeh, Khosh-Khui, et al., 2011	Menichini, Tundis, et al., 2011	Misharina T., 2011
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	DB-5 MS	DB-1	BP-1
Column length (m)	25.	60.	60.	25.
Carrier gas	Helium	Helium	Helium	Nitrogen	Nitrogen
Substrate
Column diameter (mm)	0.30	0.22	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25
T_start (C)	50.	60.	40.	60.	60.
T_end (C)	240.	230.	250.	250.	220.
Heat rate (K/min)	3.	2.	5.	4.	5.
Initial hold (min)			15.	1.	10.
Final hold (min)		30.	15.	10.	30.
I	1377.	1362.	1373.	1358.	1357.
Reference	Chalchat, Figueredo, et al., 2010	Dib, Djabou, et al., 2010	Mesa-Arango, Betancur-Galvis, et al., 2010	Mirjalili, Salehi, et al., 2010	Mishra, Chaudhary, 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	HP-5	HP-5	HP-5	HP-5 MS
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	Helium	Helium	Helium	Hydrogen	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)	40.	40.	50.	70.	70.
T_end (C)	260.	260.	240.	290.	290.
Heat rate (K/min)	4.	4.	3.	5.	5.
Initial hold (min)			5.
Final hold (min)	5.	5.			10.
I	1385.	1391.	1388.	1390.	1378.
Reference	Miyazawa, Kawauchi, et al., 2010	Miyazawa, Kawauchi, et al., 2010	Monsef-Esfahani, Miri, et al., 2010	Radulovic, Dordevic, et al., 2010	Radulovic, Dordevic, et al., 2010, 2
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	DB-1-MS	DB-5	SPB-5	DB-5 MS
Column length (m)	60.	60.	30.	30.	30.
Carrier gas	Nitrogen	Helium	Helium	Nitrogen	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.53	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.50	0.25
T_start (C)	60.	30.	80.	50.	50.
T_end (C)	250.	200.	240.	210.	250.
Heat rate (K/min)	4.	2.	3.	3.	2.
Initial hold (min)	1.	4.		5.	5.
Final hold (min)	10.	35.	2.	45.
I	1357.	1360.	1379.	1411.	1381.
Reference	Safaei-Ghomi, Meshkatalsadat, et al., 2010	Takeoka, Hobbs, et al., 2010	Vahirua-Lechat, Mitermite, et al., 2010	Gilani, Shah, et al., 2009	Koba, Sanda, 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	BP-1	DB-5	DB-5	DB-1 MS
Column length (m)	25.	50.	30.	30.	30.
Carrier gas	Helium	Helium	Helium	Nitrogen	Helium
Substrate
Column diameter (mm)	0.20	0.22	0.25	0.25	0.25
Phase thickness (μm)	0.33	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	45.	40.	40.
T_end (C)	240.	220.	250.	230.	250.
Heat rate (K/min)	3.	2.	3.	2.	6.
Initial hold (min)			3.		1.
Final hold (min)	7.	20.	5.		4.
I	1379.	1363.	1383.	1381.	1360.
Reference	Maridass, 2009	Ottavioli, Bighelli, et al., 2009	Porto, Decorti, et al., 2009	Scrivanti, Anton, 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-5MS	HP-5	ZB-1	HP-5 MS	OV-1
Column length (m)	30.	30.	30.	30.	30.
Carrier gas	Helium	Helium	Nitrogen	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.	45.	60.	65.
T_end (C)	240.	280.	230.	250.	260.
Heat rate (K/min)	5.	9.	3.	2.	6.
Initial hold (min)		3.		8.
Final hold (min)		3.		15.
I	1383.	1385.	1347.	1377.	1409.
Reference	Wannes, Mhamdi, et al., 2009	Aicha, Ines, et al., 2008	Mierendorff, Stahl-Biskup, et al., 2008	Sahraoui, Vian, et al., 2008	Wang, Yi, et al., 2008
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-5MS	CP Sil 5 CB	HP-5MS	HP-5MS	5 % Phenyl methyl siloxane
Column length (m)	30.	30.	30.	30.	60.
Carrier gas	He	N2	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)	60.	60.	60.	60.	90.
T_end (C)	240.	300.	250.	250.	225.
Heat rate (K/min)	3.	4.	2.	2.	3.
Initial hold (min)			8.	8.
Final hold (min)			15.	15.	15.
I	1379.	1369.	1394.	1382.	1384.
Reference	Argyropoulou, Daferera, et al., 2007	Baran, von Reuss, et al., 2007	Ferhat, Meklati, et al., 2007	Ferhat, Tigrine-Kordjani, et al., 2007	Gil A., Van Baren C.M., et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DBP-5	BP-1	DB-1	HP-5	DB-1
Column length (m)	25.		30.	25.	60.
Carrier gas	Helium	He	Helium	H2	He
Substrate
Column diameter (mm)	0.25		0.25	0.2	0.25
Phase thickness (μm)	0.22		0.25	0.33	0.25
T_start (C)	40.	60.	50.	60.	60.
T_end (C)	250.	220.	260.	240.	250.
Heat rate (K/min)	3.	5.	2.5	3.	5.
Initial hold (min)	1.		1.
Final hold (min)	10.	6.	20.
I	1342.	1370.	1362.	1386.	1350.
Reference	Heravi and Sereshti, 2007	Kiran, Devi, et al., 2007	Monser-Esfahani, Karamkhani, et al., 2007	Oliveira, Leitão, et al., 2007	Salehi, Fakhari, et al., 2007
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DBP-5	DB-5	HP-5	HP-5MS	HP-1
Column length (m)	25.	30.	60.	30.	50.
Carrier gas	Helium		He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.2
Phase thickness (μm)	0.22	0.25	0.25	0.25	0.5
T_start (C)	40.	40.	60.	60.	60.
T_end (C)	250.	250.	250.	280.	250.
Heat rate (K/min)	3.	2.	3.	3.	2.
Initial hold (min)	1.
Final hold (min)	10.	33.			120.
I	1342.	1385.	1381.	1380.	1354.
Reference	Sereshti and Samadi, 2007	Sylvestre, Pichette, et al., 2007	Bertrand, Comte, et al., 2006	Bozin, Mimicá-Dukic, et al., 2006	Castel, Fernandez, et al., 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	HP-1	BP-1	BP-1	HP-5MS	HP-5
Column length (m)	50.	50.	50.	30.	30.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.2	0.22	0.22	0.25	0.25
Phase thickness (μm)	0.33	0.25	0.25	0.25	0.25
T_start (C)	60.	60.	60.	50.	50.
T_end (C)	250.	220.	220.	250.	300.
Heat rate (K/min)	2.	2.	2.	2.	5.
Initial hold (min)	4.				5.
Final hold (min)	30.	20.	20.		5.
I	1354.	1358.	1358.	1383.	1378.
Reference	Castel, Fernandez, et al., 2006	Fanciullino, Tomi, et al., 2006	Fanciullino, Tomi, et al., 2006	Farah, Afifi, et al., 2006	Figuérédo, Cabassu, 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	CP Sil 5 CB	FSOT-RSL-200	BP-1	RTX-1
Column length (m)	60.	30.	30.		30.
Carrier gas			Hydrogen	Helium	He
Substrate
Column diameter (mm)	0.25	0.25	0.32		0.32
Phase thickness (μm)	0.25	0.25	0.25		0.25
T_start (C)	60.	40.	40.	60.	60.
T_end (C)	250.	220.	280.	220.	300.
Heat rate (K/min)	5.	3.	6.	5.	4.
Initial hold (min)			5.
Final hold (min)	10.	3.	5.	6.
I	1362.	1362.	1381.	1370.	1365.
Reference	Hadian, Sonboli, et al., 2006	Hymete, Rohloff, et al., 2006	Jirovetz, Eller, et al., 2006	Kiran, Bhavani, et al., 2006	Kula, Izydorczyk, 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	DB-1	CP Sil 5 CB	DB-5	HP-5
Column length (m)	60.	60.	30.	30.	30.
Carrier gas			N2	Helium	Helium
Substrate
Column diameter (mm)	0.25	0.25	0.32	0.25	0.32
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	70.	70.	50.	50.	40.
T_end (C)	230.	230.	300.	250.	240.
Heat rate (K/min)	2.	2.	4.	3.	4.
Initial hold (min)	2.	2.		5.
Final hold (min)	20.	20.			5.
I	1358.	1359.	1365.	1385.	1385.
Reference	Lan Phi N.T., Nishiyama C., et al., 2006	Lan Phi N.T., Nishiyama C., et al., 2006	Lis and Milczarek, 2006	Mirza, Navaei, et al., 2006	Miyazawa and Kawata, 2006
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	NB-30	DB-5	DB-5	HP-5	DB-1
Column length (m)	30.	25.	30.	30.	60.
Carrier gas	He	N2	He	He
Substrate
Column diameter (mm)	0.2	0.25	0.32	0.25	0.25
Phase thickness (μm)	0.25	0.15	0.25	0.25	0.25
T_start (C)	50.	50.	60.	60.	70.
T_end (C)	250.	200.	280.	220.	230.
Heat rate (K/min)	2.	4.	5.	5.	2.
Initial hold (min)		3.	0.5	10.	2.
Final hold (min)			2.		20.
I	1371.	1387.	1382.	1386.	1361.
Reference	Orav, Raal, et al., 2006	Ouamba, Ouabonzi, et al., 2006	Ozel, Gogus, et al., 2006	Pintore G., Chessa M., et al., 2006	Sawamura, Onishi, 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-1	SPB-5	BPX-5	SPB-1
Column length (m)	30.	60.		50.	50.
Carrier gas	H2	Helium	He		He
Substrate
Column diameter (mm)	0.20	0.25		0.22	0.2
Phase thickness (μm)	0.18	0.25		1.	0.33
T_start (C)	60.	60.	50.	70.	50.
T_end (C)	240.	250.	250.	280.	220.
Heat rate (K/min)	3.	5.	5.	4.	4.
Initial hold (min)			3.		1.
Final hold (min)		10.	15.	4.	10.
I	1383.	1355.	1379.	1388.	1363.
Reference	Silva, Oliveira, et al., 2006	Sonboli, Mirjalili, et al., 2006	Stojanovic, Palic, et al., 2006	Wohlmuth, Smith, et al., 2006	Wong, Lim, 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	DB-1	HP-5	HP-5MS
Column length (m)	30.	25.	60.	30.	25.
Carrier gas	He	He	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
T_start (C)	40.	60.	60.	50.	50.
T_end (C)	250.	240.	250.	300.	250.
Heat rate (K/min)	4.	3.	5.	5.	3.
Initial hold (min)				5.	3.
Final hold (min)		7.		5.	10.
I	1369.	1382.	1362.	1378.	1387.
Reference	Yadegarinia, Gachkar, et al., 2006	Duarte, Figueira, et al., 2005	Fakhari, Salehi, et al., 2005	Figuérédo, Cabassu, et al., 2005	Ghasemi Y., Faridi P., et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	SPB-1	HP-5MS	Methyl Silicone	HP-5MS	HP-5MS
Column length (m)	30.	30.	12.5	30.	30.
Carrier gas			He	He
Substrate
Column diameter (mm)	0.25	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.2		0.25	0.25	0.25
T_start (C)	60.	60.	50.	60.	40.
T_end (C)	250.	280.	270.	280.	220.
Heat rate (K/min)	6.	3.	4.	3.	3.
Initial hold (min)	2.			5.	5.
Final hold (min)					10.
I	1363.	1381.	1363.	1387.	1381.
Reference	Hamilton, Hall, et al., 2005	Petrakis, Roussis, et al., 2005	Ricci, Fraternale, et al., 2005	Setzer, Noletto, et al., 2005	Vichi, Riu-Aumatell, et al., 2005
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	SPB-1	SPB-1	DB-1	DB-5	RTX-1
Column length (m)	50.	50.	60.	60.	30.
Carrier gas	He	He	N2	He	N2
Substrate
Column diameter (mm)	0.2	0.2	0.25	0.25	0.32
Phase thickness (μm)	0.33	0.33	0.25	0.25	0.25
T_start (C)	50.	50.	70.	40.	60.
T_end (C)	220.	220.	230.	280.	300.
Heat rate (K/min)	4.	4.	2.	4.	4.
Initial hold (min)	3.	3.	2.	4.
Final hold (min)	30.	30.	20.
I	1362.	1360.	1340.	1383.	1361.
Reference	Wong, Lee, et al., 2005	Wong and Tan, 2005	Choi, 2004	Kalvandi, Sefidkon, et al., 2004	Lis, Boczek, 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	DB-5MS	HP-5MS	NB-30	NB-30
Column length (m)	30.	30.	30.	50.	50.
Carrier gas		He	He	He	He
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.2	0.20
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	40.	60.	60.	50.	50.
T_end (C)	210.	280.	280.	250.	250.
Heat rate (K/min)	2.	3.	3.	2.	2.
Initial hold (min)	2.
Final hold (min)	33.	30.
I	1385.	1354.	1380.	1364.	1362.
Reference	Lopez Arze, Collin, et al., 2004	Marongiu, Piras, et al., 2004	Mimica-Dukic, Bozin, 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	HP-5MS	DB-1	DB-1	HP-5MS	DB-1
Column length (m)	30.	60.	60.	30.	60.
Carrier gas	He		Nitrogen	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.	70.	70.	60.	70.
T_end (C)	280.	230.	230.	275.	230.
Heat rate (K/min)	4.	2.	2.	4.	2.
Initial hold (min)		2.	2.		2.
Final hold (min)		20.			20.
I	1379.	1340.	1340.	1382.	1340.
Reference	Sadeghpour, Asghari, et al., 2004	Sawamura, Son, et al., 2004	Sawamura, Sou, et al., 2004	Afsharypuor and Jahromy, 2003	Choi, 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	Methyl Silicone	RTX-5Sil	DB-1	RSL-200	DB-5
Column length (m)	12.5	30.	30.	30.	50.
Carrier gas	He	He	N2	H2	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
T_start (C)	50.	70.	50.	40.	50.
T_end (C)	270.	200.	200.	280.	220.
Heat rate (K/min)	4.	4.	5.	6.	3.
Initial hold (min)				2.	2.
Final hold (min)		10.		10.	10.
I	1363.	1383.	1345.	1378.	1388.
Reference	Curini, Bianchi, et al., 2003	Dudai, Larkov, et al., 2003	Fekam Boyom, Ngouana, et al., 2003	Jirovetz, Buchbauer, et al., 2003	Juteau, Jerkovic, et al., 2003
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5MS	ZB-1	MPS-5	HP-5	DB-1
Column length (m)	30.	30.		30.	60.
Carrier gas	He	N2		He	He
Substrate
Column diameter (mm)	0.25	0.25		0.25	0.25
Phase thickness (μm)	0.25	0.25		0.25	0.25
T_start (C)	60.	45.	70.	60.	40.
T_end (C)	240.	230.	180.	280.	220.
Heat rate (K/min)	3.	3.	5.	3.	4.
Initial hold (min)			2.
Final hold (min)
I	1382.	1362.	1380.	1365.	1364.
Reference	Maia, Taveira, et al., 2003	Mierendorff, Stahl-Biskup, et al., 2003	Nakahara, Alzoreky, et al., 2003	Pitarokili, Tzakou, et al., 2003	Rasooli and Mirmostafa, 2003
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-5	BP-1
Column length (m)	30.	60.	60.	30.	25.
Carrier gas	He	N2	N2	He	N2
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.50
Phase thickness (μm)	0.25	0.25	0.25	0.25	0.25
T_start (C)	60.	70.	70.	60.	60.
T_end (C)	240.	230.	230.	280.	220.
Heat rate (K/min)	3.	2.	2.	3.	5.
Initial hold (min)		2.	2.
Final hold (min)		20.	20.	30.	10.
I	1384.	1344.	1369.	1376.	1359.
Reference	da Silva, Luz, et al., 2003	Tu, Onishi, et al., 2003	Tu, Onishi, et al., 2003, 2	Caredda, Marongiu, et al., 2002	Das, Ram, et al., 2002
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	HP-5	CP Sil 8 CB	SPB-5	DB-5
Column length (m)	30.	30.	30.	60.	30.
Carrier gas	H2	He	He	He	He
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)	40.	60.	50.	50.	40.
T_end (C)	245.	275.	220.	240.	290.
Heat rate (K/min)	3.	4.	3.	5.	7.
Initial hold (min)	20.		2.	3.
Final hold (min)				10.
I	1357.	1380.	1386.	1349.	1398.
Reference	Gancel, Ollé, et al., 2002	Ghannadi, Sajjadi, et al., 2002	Juteau, Masotti, et al., 2002	Kim and Lee, 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	DB-1	OV-101	DB-1	DB-5MS	BP-1
Column length (m)	30.	50.	60.	30.	30.
Carrier gas	He	He	He	He	N2
Substrate
Column diameter (mm)	0.25	0.2	0.25	0.25	0.25
Phase thickness (μm)	0.25	0.5	0.25	0.25	0.25
T_start (C)	60.	50.	40.	60.	60.
T_end (C)	250.	250.	280.	270.	220.
Heat rate (K/min)	4.	2.	4.	3.	5.
Initial hold (min)	10.		5.
Final hold (min)
I	1387.	1365.	1356.	1384.	1365.
Reference	Norouzi-Arasi, Yavari, et al., 2002	Orav, Kailas, et al., 2002	Sefidkon, Jalili, et al., 2002	Zoghbi, Andrade, et al., 2002	Gupta, Mallavarapu, et al., 2001
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	SPB-1	SPB-5	BP-1	CBP-1	DB-5
Column length (m)	30.	60.	50.	25.	60.
Carrier gas	N2	Helium	He	Nitrogen	He
Substrate
Column diameter (mm)	0.25	0.25	0.22	0.25	0.25
Phase thickness (μm)	0.25	0.25	0.25	0.25
T_start (C)	70.	50.	60.	50.	50.
T_end (C)	180.	240.	230.	210.	250.
Heat rate (K/min)	2.	3.	2.	3.	3.
Initial hold (min)	2.	3.		2.	5.
Final hold (min)	1.	10.	35.
I	1364.	1349.	1358.	1361.	1383.
Reference	Kamath, Asha, et al., 2001	Kim and Lee, 2001	Lota, de Rocca Serra, et al., 2001	Ly, Yamauchi, et al., 2001	Rousis, Papadogianni, 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	SPB-1	RSL-200	SPB-5	DB-5
Column length (m)	30.	30.	60.	60.	30.
Carrier gas	H2	He	H2	He	N2
Substrate
Column diameter (mm)	0.25	0.2	0.32	0.25	0.22
Phase thickness (μm)	0.25	0.2	0.25	0.25	0.25
T_start (C)	60.	80.	40.	70.	70.
T_end (C)	285.	300.	250.	240.	230.
Heat rate (K/min)	3.	5.	6.	5.	4.
Initial hold (min)		3.		8.	2.
Final hold (min)				20.	20.
I	1383.5	1385.	1364.	1382.	1379.
Reference	Santos-Gomes and Fernandes-Ferreira, 2001	Fraternale, Giamperi, et al., 2000	Jirovetz, Puschmann, et al., 2000	Kim, Kim, et al., 2000	Mitiku, Sawamura, et al., 2000
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	SPB-1	BP-1	DB-5	OV-1	DB-1
Column length (m)	50.	25.	30.	25.	60.
Carrier gas		N2	He	H2	He
Substrate
Column diameter (mm)	0.2	0.50	0.25	0.25	0.25
Phase thickness (μm)	0.33	0.25		0.25	0.25
T_start (C)	60.	60.	40.	40.	40.
T_end (C)	260.	220.	230.	220.	280.
Heat rate (K/min)	4.	5.	4.	3.	4.
Initial hold (min)			1.	5.	5.
Final hold (min)		10.		5.
I	1359.	1359.	1375.	1363.	1361.
Reference	Choo, Wong, et al., 1999	Mallavarapu, Kulkarni, et al., 1999	Mockute and Bernotiene, 1999	Oberhofer, Nikiforov, et al., 1999	Sefidkon, Dabiri, et al., 1999
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	OV-101	SE-30	HP-5	CP Sil 5 CB	CP Sil 5 CB
Column length (m)	25.	25.	25.	25.	25.
Carrier gas	Nitrogen	He	He	N2	N2
Substrate
Column diameter (mm)	0.20	0.2	0.2	0.32	0.32
Phase thickness (μm)			0.33	0.25	0.25
T_start (C)	60.	60.	70.	50.	50.
T_end (C)	220.	180.	290.	290.	290.
Heat rate (K/min)	4.	3.	3.	4.	4.
Initial hold (min)	0.	10.	8.
Final hold (min)	0.		20.
I	1364.	1363.	1384.	1360.	1360.
Reference	Tropnikova, Zenkevich, et al., 1999	Jantan, Ahmad, et al., 1998	Poiana, Sicari, et al., 1998	Bos, Woerdenbag, et al., 1997	Bos, Woerdenbag, 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	OV-101	BP-1	BP-1	BP-1
Column length (m)	30.	50.	25.	25.	25.
Carrier gas	He	He	N2	N2	N2
Substrate
Column diameter (mm)	0.25	0.25	0.50	0.50	0.50
Phase thickness (μm)	0.25
T_start (C)	50.	50.	60.	60.	60.
T_end (C)	250.	250.	220.	220.	220.
Heat rate (K/min)	2.	2.	5.	5.	5.
Initial hold (min)	5.
Final hold (min)
I	1362.	1363.	1361.	1362.	1363.
Reference	Reverchon, Porta, et al., 1997	Orav, Kailas, et al., 1996	Rajeswara, Kaul, et al., 1996	Rajeswara, Kaul, et al., 1996	Rajeswara, Kaul, et al., 1996
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	OV-101	OV-101	DB-1	DB-1
Column length (m)	60.	52.	50.	60.	60.
Carrier gas	He	He	He	He	He
Substrate
Column diameter (mm)	0.32	0.26	0.2	0.25	0.25
Phase thickness (μm)	0.50		0.5	0.25	0.25
T_start (C)	50.	50.	70.	50.	70.
T_end (C)	250.	220.	180.	250.	270.
Heat rate (K/min)	8.	3.	1.	3.5	2.5
Initial hold (min)	1.			5.	5.
Final hold (min)	6.
I	1362.	1361.	1361.	1359.	1357.
Reference	Sagrero-Nieves and Bartley, 1996	Dzumayev, Tsibulskaya, et al., 1995	Orav, Kuningas, et al., 1995	Stashenko, Torres, et al., 1995	Tirado, Stashenko, et al., 1995
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-5 MS	Methyl Silicone	Methyl Silicone	OV-101	OV-101
Column length (m)	30.	50.	50.	50.	50.
Carrier gas	Helium	N2	N2
Substrate
Column diameter (mm)	0.25	0.25	0.25	0.25	0.25
Phase thickness (μm)		0.17	0.17
T_start (C)	50.	80.	80.	80.	80.
T_end (C)	250.	200.	200.	200.	200.
Heat rate (K/min)	4.	2.	3.	2.	2.
Initial hold (min)
Final hold (min)
I	1377.	1363.	1364.	1359.	1362.
Reference	Gomez and Ledbetter, 1994	Gopalakrishnan, Menon, et al., 1993	Gopalakrishnan, Menon, et al., 1993	Tamura, Yang, et al., 1993	Tamura, Yang, et al., 1993
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	DB-1	OV-101	OV-101	OV-101	OV-1
Column length (m)	30.	50.	50.	50.	60.
Carrier gas	N2	N2	N2	N2	Helium
Substrate
Column diameter (mm)		0.25	0.25	0.25	0.50
Phase thickness (μm)					1.2
T_start (C)	80.	80.	80.	80.	40.
T_end (C)	220.	200.	200.	200.	220.
Heat rate (K/min)	4.	2.	2.	2.	2.
Initial hold (min)
Final hold (min)
I	1357.	1362.	1364.	1362.	1361.
Reference	Velasco-Negueruela, Pérez Alonso, et al., 1991	Yang and Sugisawa, 1990	Yang and Sugisawa, 1990	Sugisawa, Yamamoto, et al., 1989	Wahab, Aboutabl, et al., 1987
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary
Active phase	OV-101	DB-1
Column length (m)	30.	60.
Carrier gas	He
Substrate
Column diameter (mm)	0.5	0.32
Phase thickness (μm)	0.8
T_start (C)	40.	50.
T_end (C)	220.	250.
Heat rate (K/min)	2.	4.
Initial hold (min)		0.1
Final hold (min)		5.
I	1367.	1358.
Reference	De Pooter and Schamp, 1986	Flath, Mon, et al., 1983
Comment	MSDC-RI	MSDC-RI

References

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

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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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