1-Octene
- Formula: C8H16
- Molecular weight: 112.2126
- IUPAC Standard InChIKey: KWKAKUADMBZCLK-UHFFFAOYSA-N
- CAS Registry Number: 111-66-0
- 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. - Other names: α-Octene; α-Octylene; n-1-Octene; Caprylene; 1-C8H16; Oct-1-ene; Octene-1; Neodene 8; Octylene; 1-n-Octene; NSC 8457; SHOP C8
- Permanent link for this species. Use this link for bookmarking this species for future reference.
- Information on this page:
- Other data available:
- Data at other public NIST sites:
- Options:
Data at NIST subscription sites:
NIST subscription sites provide data under the NIST Standard Reference Data Program, but require an annual fee to access. The purpose of the fee is to recover costs associated with the development of data collections included in such sites. Your institution may already be a subscriber. Follow the links above to find out more about the data in these sites and their terms of usage.
Van Den Dool and Kratz RI, non-polar column, temperature ramp
Go To: Top, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | RTX-5 | CP-Sil 8CB-MS | HP-5 | CP-Sil 8CB-MS | DB-1 |
Column length (m) | 30. | 0. | 50. | 60. | 30. |
Carrier gas | N2 | He | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 1.05 | 0.25 | 0.25 |
Tstart (C) | 40. | 40. | 35. | 40. | 40. |
Tend (C) | 300. | 280. | 220. | 280. | 250. |
Heat rate (K/min) | 5. | 4. | 8. | 4. | 2. |
Initial hold (min) | 2. | 2. | 15. | 2. | 5. |
Final hold (min) | 10. | 5. | 5. | 5. | |
I | 792.9 | 789. | 794. | 792. | 785. |
Reference | Ádámová, Orinák, et al., 2005 | Elmore, Cooper, et al., 2005 | Insausti, Goñi, et al., 2005 | Hierro, de la Hoz, et al., 2004 | de Feo, Urrunaga Soria, et al., 2003 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | SPB-1 | DB-5 | DB-5 | DB-5 | DB-5 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | He | He | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 40. | 40. | 40. | 40. | 40. |
Tend (C) | 250. | 310. | 310. | 310. | 310. |
Heat rate (K/min) | 10. | 4. | 4. | 2. | 4. |
Initial hold (min) | 2. | 5. | |||
Final hold (min) | 2. | ||||
I | 782.40 | 789.3 | 788.4 | 788.3 | 789.3 |
Reference | LECO Corporation, 2003 | Song, Lai, et al., 2003 | Song, Lai, et al., 2003 | Song, Lai, et al., 2003 | Song, Lai, et al., 2003 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | DB-5 | DB-1 | DB-1 | DB-1 |
Column length (m) | 30. | 30. | 60. | 10. | 30. |
Carrier gas | He | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 1. | 1. | 0.25 | 1. |
Tstart (C) | 40. | 50. | -50. | 30. | -50. |
Tend (C) | 310. | 200. | 175. | 225. | 180. |
Heat rate (K/min) | 6. | 2.5 | 6. | 2. | 6. |
Initial hold (min) | 2. | ||||
Final hold (min) | |||||
I | 789.1 | 789.6 | 788.4 | 785. | 789.7 |
Reference | Song, Lai, et al., 2003 | Xu, van Stee, et al., 2003 | Helmig, Klinger, et al., 1999 | Beens, Tijssen, et al., 1998 | Helmig, Pollock, et al., 1996 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | DB-5 | DB-5 | DB-5 | DB-5 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 40. | 40. | 40. | 40. | 40. |
Tend (C) | 310. | 310. | 310. | 310. | 310. |
Heat rate (K/min) | 2. | 4. | 6. | 4. | 4. |
Initial hold (min) | 5. | ||||
Final hold (min) | |||||
I | 788.3 | 789.3 | 789.1 | 789.3 | 788.4 |
Reference | Lai and Song, 1995 | Lai and Song, 1995 | Lai and Song, 1995 | Lai and Song, 1995 | Lai and Song, 1995 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Petrocol DH | Methyl Silicone | Ultra-1 | Ultra-1 | Ultra-1 |
Column length (m) | 100. | 50. | 50. | 50. | 50. |
Carrier gas | He | He | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.20 | 0.22 | 0.22 | 0.22 |
Phase thickness (μm) | 0.5 | 0.33 | 0.33 | 0.33 | |
Tstart (C) | 30. | 20. | -30. | -30. | -30. |
Tend (C) | 220. | 250. | 240. | 240. | 240. |
Heat rate (K/min) | 1. | 2. | 1. | 2. | 3. |
Initial hold (min) | 5. | ||||
Final hold (min) | |||||
I | 787. | 787. | 789.04 | 788.99 | 789.05 |
Reference | White, Hackett, et al., 1992 | Takeda, 1991 | Haynes and Pitzer, 1985 | Haynes and Pitzer, 1985 | Haynes and Pitzer, 1985 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Ultra-2 | Ultra-2 | Ultra-2 | OV-101 | Chromosorb 101 |
Column length (m) | 50. | 50. | 50. | 108. | |
Carrier gas | He | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.22 | 0.22 | 0.22 | 0.25 | |
Phase thickness (μm) | 0.33 | 0.33 | 0.33 | 0.2 | |
Tstart (C) | -30. | -30. | -30. | 35. | 0. |
Tend (C) | 240. | 240. | 240. | 200. | 220. |
Heat rate (K/min) | 1. | 2. | 3. | 1. | 10. |
Initial hold (min) | |||||
Final hold (min) | |||||
I | 791.72 | 791.76 | 791.77 | 786. | 799. |
Reference | Haynes and Pitzer, 1985 | Haynes and Pitzer, 1985 | Haynes and Pitzer, 1985 | Hayes and Pitzer, 1981 | Voorhees, Hileman, et al., 1975 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Ádámová, Orinák, et al., 2005
Ádámová, M.; Orinák, A.; Halás, L.,
Retention indices as identification tool in pyrolysis-capillary gas chromatography,
J. Chromatogr. A, 2005, 1087, 1-2, 131-141, https://doi.org/10.1016/j.chroma.2005.01.003
. [all data]
Elmore, Cooper, et al., 2005
Elmore, J.S.; Cooper, S.L.; Enser, M.; Mottram, D.S.; Sinclair, L.A.; Wilkinson, R.G.; Wood, J.D.,
Dietary manipulation of fatty acid composition in lamb meat and its effect on the volatile aroma compounds of grilled lamb,
Meat Sci., 2005, 69, 2, 233-242, https://doi.org/10.1016/j.meatsci.2004.07.002
. [all data]
Insausti, Goñi, et al., 2005
Insausti, K.; Goñi, V.; Petri, E.; Gorraiz, C.; Beriain, M.J.,
Effect of weight at slaughter on the volatile compounds of cooked beef from Spanish cattle breeds,
Meat Sci., 2005, 70, 1, 83-90, https://doi.org/10.1016/j.meatsci.2004.12.003
. [all data]
Hierro, de la Hoz, et al., 2004
Hierro, E.; de la Hoz, L.; Ordóñez, J.A.,
Headspace volatile compounds from salted and occasionally smoked dried meats (cecinas) as affected by animal species,
Food Chem., 2004, 85, 4, 649-657, https://doi.org/10.1016/j.foodchem.2003.07.001
. [all data]
de Feo, Urrunaga Soria, et al., 2003
de Feo, V.; Urrunaga Soria, E.; Urrunaga Soria, R.; Senatore, F.,
Chemical composition of essential oils of senecio nutans Sch.-Bip. (Asteraceae),
Flavour Fragr. J., 2003, 18, 3, 234-236, https://doi.org/10.1002/ffj.1204
. [all data]
LECO Corporation, 2003
LECO Corporation,
Determination of hydrocarbon components in petroleum naphthas, 2003, retrieved from http://www.leco.org/customersupport/apps/separationscience/-190.pdf. [all data]
Song, Lai, et al., 2003
Song, C.; Lai, W.-C.; Madhusudan Reddy, K.; Wei, B.,
Chapter 7. Temperature-programmed retention indices for GC and GC-MS of hydrocarbon fuels and simulated distillation GC of heavy oils
in Analytical advances for hydrocarbon research, Hsu,C.S., ed(s)., Kluwer Academic/Plenum Publishers, New York, 2003, 147-193. [all data]
Xu, van Stee, et al., 2003
Xu, X.; van Stee, L.L.P.; Williams, J.; Beens, J.; Adahchour, M.; Vreuls, R.J.J.; Brinkman, U.A.Th.; Lelieveld, J.,
Comprehensive two-dimensional gas chromatography (GC×GC) measurements of volatile organic compounds in the atmosphere,
Atmos. Chem. Phys., 2003, 3, 3, 665-682, https://doi.org/10.5194/acp-3-665-2003
. [all data]
Helmig, Klinger, et al., 1999
Helmig, D.; Klinger, L.F.; Guenther, A.; Vierling, L.; Geron, C.; Zimmerman, P.,
Biogenic volatile organic compound emissions (BVOCs). I. Identifications from three continental sites in the U.S.,
Chemosphere, 1999, 38, 9, 2163-2187, https://doi.org/10.1016/S0045-6535(98)00425-1
. [all data]
Beens, Tijssen, et al., 1998
Beens, J.; Tijssen, R.; Blomberg, J.,
Prediction of comprehensive two-dimensional gas chromatographic separations. A theoretical and practical exercise,
J. Chromatogr. A, 1998, 822, 2, 233-251, https://doi.org/10.1016/S0021-9673(98)00649-9
. [all data]
Helmig, Pollock, et al., 1996
Helmig, D.; Pollock, W.; Greenberg, J.; Zimmerman, P.,
Gas chromatography mass spectrometry analysis of volatile organic trace gases at Mauna Loa Observatory, Hawaii,
J. Geophys. Res., 1996, 101, D9, 14697-14710, https://doi.org/10.1029/96JD00212
. [all data]
Lai and Song, 1995
Lai, W.-C.; Song, C.,
Temperature-programmed retention indices for g.c. and g.c.-m.s. analysis of coal- and petroleum-derived liquid fuels,
Fuel, 1995, 74, 10, 1436-1451, https://doi.org/10.1016/0016-2361(95)00108-H
. [all data]
White, Hackett, et al., 1992
White, C.M.; Hackett, J.; Anderson, R.R.; Kail, S.; Spock, P.S.,
Linear temperature programmed retention indices of gasoline range hydrocarbons and chlorinated hydrocarbons on cross-linked polydimethylsiloxane,
J. Hi. Res. Chromatogr., 1992, 15, 2, 105-120, https://doi.org/10.1002/jhrc.1240150211
. [all data]
Takeda, 1991
Takeda, I.,
Use of literature values of temperature programmed retention indexes in qualitative analysis by isothermal gas chromatography,
J. Hi. Res. Chromatogr., 1991, 14, 12, 824-828, https://doi.org/10.1002/jhrc.1240141209
. [all data]
Haynes and Pitzer, 1985
Haynes, P.C., Jr.; Pitzer, E.W.,
Disengaging solutes in shale- and petroleum-derived jet fuels by altering GC programmed temperature rates,
J. Hi. Res. Chromatogr. Chromatogr. Comm., 1985, 8, 5, 230-242, https://doi.org/10.1002/jhrc.1240080504
. [all data]
Hayes and Pitzer, 1981
Hayes, P.C., Jr.; Pitzer, E.W.,
Kovats indices as a tool in characterizing hydrocarbon fuels in temperature programmed glass capillary gas chromatography. Part 1. Qualitative identification, Inhouse rpt. for Air Force Wright Aeronautical Labs., Air Force Wright Aeronautical Labs., Wright-Patterson AFB, Ohio, 1981, 75. [all data]
Voorhees, Hileman, et al., 1975
Voorhees, K.J.; Hileman, F.D.; Einhorn, I.N.,
Generation of retention index standards by pyrolysis of hydrocarbons,
Anal. Chem., 1975, 47, 14, 2385-2389, https://doi.org/10.1021/ac60364a035
. [all data]
Notes
Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
- The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
- Customer support for NIST Standard Reference Data products.