Ethylbenzene
- Formula: C8H10
- Molecular weight: 106.1650
- IUPAC Standard InChIKey: YNQLUTRBYVCPMQ-UHFFFAOYSA-N
- CAS Registry Number: 100-41-4
- 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. - Isotopologues:
- Other names: Benzene, ethyl-; Ethylbenzol; EB; Phenylethane; Aethylbenzol; Ethylbenzeen; Etilbenzene; Etylobenzen; NCI-C56393; UN 1175; α-Methyltoluene; NSC 406903
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Normal alkane 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 | Polydimethyl siloxane: CP-Sil 5 CB | HP-5 MS | Petrocol DH | VF-5 MS | VF-5 MS |
Column length (m) | 60. | 30. | 100. | 60. | 60. |
Carrier gas | Helium | Helium | Helium | Helium | Helium |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.32 | 0.32 |
Phase thickness (μm) | 1.0 | 0.25 | 0.50 | 0.25 | 0.25 |
Tstart (C) | 45. | 35. | 20. | 30. | 30. |
Tend (C) | 210. | 300. | 220. | 260. | 260. |
Heat rate (K/min) | 3.6 | 3. | 15. | 2. | 2. |
Initial hold (min) | 1.45 | 5. | 15. | ||
Final hold (min) | 2.72 | 15. | 30. | 28. | 28. |
I | 852. | 857. | 849. | 858. | 864. |
Reference | Bramston-Cook, 2013 | Kotowska, Zalikowski, et al., 2012 | Supelco, 2012 | Leffingwell and Alford, 2011 | Leffingwell and Alford, 2011 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-5 | ZB-5 | PONA | VF-5MS | SPB-5 |
Column length (m) | 30. | 30. | 50. | 30. | 60. |
Carrier gas | Helium | Helium | Nitrogen | ||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.25 | 0.20 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.50 | 0.25 | 1. |
Tstart (C) | 35. | 40. | 35. | 40. | 40. |
Tend (C) | 200. | 280. | 200. | 250. | 230. |
Heat rate (K/min) | 2. | 6. | 2. | 7. | 3. |
Initial hold (min) | 1. | 15. | 5. | ||
Final hold (min) | 9. | 10. | 5. | ||
I | 845. | 863. | 851. | 851. | 866. |
Reference | Pattiram, Lasekan, et al., 2011 | Harrison and Priest, 2009 | Zhang, Ding, et al., 2009 | Ghiasvand, Setkova, et al., 2007 | Vasta, Ratel, et al., 2007 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-1 | BPX-5 | HP-1 | HP-5 | DB-5 |
Column length (m) | 50. | 25. | 50. | 60. | 30. |
Carrier gas | He | Helium | He | H2 | |
Substrate | |||||
Column diameter (mm) | 0.2 | 0.20 | 0.2 | 0.32 | 0.25 |
Phase thickness (μm) | 0.33 | 0.13 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 60. | 50. | 60. | 30. | 60. |
Tend (C) | 250. | 230. | 250. | 260. | 280. |
Heat rate (K/min) | 2. | 3. | 2. | 2. | 4. |
Initial hold (min) | 4. | 2. | 60. | 2. | 10. |
Final hold (min) | 30. | 28. | 40. | ||
I | 845. | 861. | 846. | 863.3 | 868. |
Reference | Castel, Fernandez, et al., 2006 | Fons, Rapior, et al., 2006 | Fernandez, Lizzani-Cuvelier, et al., 2005 | Leffingwell and Alford, 2005 | Pino, Marbot, 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 | BP-1 | 5 % Phenyl methyl siloxane | HP-5 | SPB-5 |
Column length (m) | 30. | 25. | 15. | 30. | 60. |
Carrier gas | He | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.2 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.1 | 0.25 | 0.25 | |
Tstart (C) | 40. | 40. | 40. | 50. | 50. |
Tend (C) | 200. | 250. | 250. | 200. | 240. |
Heat rate (K/min) | 3. | 8. | 5. | 3. | 5. |
Initial hold (min) | 10. | 5. | 3. | ||
Final hold (min) | 2. | 10. | |||
I | 829. | 846. | 886. | 859. | 866. |
Reference | Vichi, Pizzale, et al., 2003 | Hayes R.A., Richardson B.J., et al., 2002 | Hussam, Alauddin, et al., 2002 | Isidorov and Jdanova, 2002 | Kim and Lee, 2002 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | SPB-5 | SPB-5 | DB-5 | BP-1 | DB-5MS |
Column length (m) | 30. | 60. | 30. | 50. | 30. |
Carrier gas | Helium | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.22 | 0.25 |
Phase thickness (μm) | 0.25 | 1. | 0.25 | 0.75 | 0.25 |
Tstart (C) | 60. | 40. | 60. | 50. | 40. |
Tend (C) | 250. | 200. | 240. | 200. | 250. |
Heat rate (K/min) | 4. | 3. | 3. | 5. | 3. |
Initial hold (min) | 2. | 1. | |||
Final hold (min) | 20. | ||||
I | 860. | 865. | 878. | 855. | 849. |
Reference | Pino, Marbot, et al., 2002 | Poligné, Collignan, et al., 2001 | Tellez, Schrader, et al., 2001 | Health Safety Executive, 2000 | Shoenmakers, Oomen, et al., 2000 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Methyl Silicone | OV-1 | OV-101 | HP-5 | SP-2100 |
Column length (m) | 60. | 50. | 30. | 30. | |
Carrier gas | Helium | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.20 | 0.25 | 0.25 | |
Phase thickness (μm) | 0.25 | 0.50 | 0.25 | ||
Tstart (C) | 40. | 50. | 30. | 35. | 40. |
Tend (C) | 220. | 160. | 100. | 300. | 280. |
Heat rate (K/min) | 5. | 2. | 1. | 10. | 5. |
Initial hold (min) | 10. | 6. | 2. | 3. | |
Final hold (min) | 10. | ||||
I | 847.66 | 851. | 847. | 868.1 | 843. |
Reference | Baraldi, Rapparini, et al., 1999 | Orav, Kailas, et al., 1999 | Orav, Kailas, et al., 1999, 2 | Wang and Fingas, 1995 | Fischer and Kusch, 1993 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-1 | DB-1 | DB-1 | OV-1 | OV-1 |
Column length (m) | 30. | 30. | 60. | 50. | 50. |
Carrier gas | He | He | He | H2 | H2 |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 1.2 | 0.52 | 0.52 |
Tstart (C) | 50. | 50. | 30. | 30. | 35. |
Tend (C) | 240. | 240. | 240. | ||
Heat rate (K/min) | 5. | 5. | 3. | 1. | 2. |
Initial hold (min) | 3. | 3. | 10. | ||
Final hold (min) | |||||
I | 846. | 850. | 852. | 838. | 841. |
Reference | Shiota, 1993 | Shiota, 1993 | Ciccioli, Cecinato, et al., 1992 | Guan, Zheng, et al., 1992 | Guan, Zheng, et al., 1992 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | CP Sil 5 CB | DB-5 | DB-5 | DB-1 | DB-1 |
Column length (m) | 25. | 60. | 60. | 60. | 60. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.45 | 1.0 | 0.25 | 0.25 | |
Tstart (C) | 0. | 40. | 40. | 50. | 50. |
Tend (C) | 320. | 240. | 160. | 240. | 240. |
Heat rate (K/min) | 3. | 3. | 2. | 3. | 3. |
Initial hold (min) | 5. | 5. | |||
Final hold (min) | 10. | ||||
I | 842. | 856. | 869. | 843. | 850. |
Reference | Hartgers, Damste, et al., 1992 | Berdague, Denoyer, et al., 1991 | Macku and Shibamoto, 1991 | Shiota, 1991 | Shiota, 1991 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | OV-101 | DB-1 | DB-1 | DB-1 | HP-5 |
Column length (m) | 54. | 60. | 60. | 50. | |
Carrier gas | Helium | H2 | |||
Substrate | |||||
Column diameter (mm) | 0.26 | 0.32 | 0.32 | 0.3 | |
Phase thickness (μm) | |||||
Tstart (C) | 50. | 50. | 50. | 50. | 80. |
Tend (C) | 240. | 230. | 230. | 230. | 250. |
Heat rate (K/min) | 5. | 4. | 4. | 4. | 16. |
Initial hold (min) | 0. | ||||
Final hold (min) | 0. | 10. | 10. | 10. | |
I | 848. | 844. | 844. | 844. | 868. |
Reference | Zenkevich and Ventura, 1991 | Binder, Benson, et al., 1990 | Binder, Turner, et al., 1990 | Binder, Turner, et al., 1990, 2 | Spadone, Takeoka, et al., 1990 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | OV-101 | OV-101 | Squalane | Squalane | Squalane |
Column length (m) | 50. | 50. | 100. | 100. | 100. |
Carrier gas | Nitrogen | Nitrogen | |||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | |||||
Tstart (C) | 70. | 80. | |||
Tend (C) | 200. | 200. | |||
Heat rate (K/min) | 2. | 2. | 0.1 | 0.2 | 0.4 |
Initial hold (min) | |||||
Final hold (min) | |||||
I | 846. | 850. | 835.3 | 837.6 | 840.8 |
Reference | Sugisawa, Nakamura, et al., 1990 | Sugisawa, Nakamura, et al., 1990 | Krupcik, Cellar, et al., 1986 | Krupcik, Cellar, et al., 1986 | Krupcik, Cellar, et al., 1986 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Squalane | Squalane | Squalane | Squalane | Squalane |
Column length (m) | 100. | 100. | 100. | 180. | 180. |
Carrier gas | |||||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | |||||
Tstart (C) | 40. | 40. | |||
Tend (C) | |||||
Heat rate (K/min) | 0.6 | 0.8 | 1. | 0.1 | 0.2 |
Initial hold (min) | |||||
Final hold (min) | |||||
I | 843.3 | 845.3 | 847.0 | 835. | 837. |
Reference | Krupcik, Cellar, et al., 1986 | Krupcik, Cellar, et al., 1986 | Krupcik, Cellar, et al., 1986 | Krupcik, Cellar, et al., 1986, 2 | Krupcik, Cellar, et al., 1986, 2 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Squalane | Squalane | Squalane | Squalane | DB-1 |
Column length (m) | 180. | 180. | 180. | 180. | 50. |
Carrier gas | |||||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | |||||
Tstart (C) | 40. | 40. | 40. | 40. | 0. |
Tend (C) | 250. | ||||
Heat rate (K/min) | 0.4 | 0.6 | 0.8 | 1.0 | 3. |
Initial hold (min) | |||||
Final hold (min) | |||||
I | 840. | 843. | 845. | 846. | 842. |
Reference | Krupcik, Cellar, et al., 1986, 2 | Krupcik, Cellar, et al., 1986, 2 | Krupcik, Cellar, et al., 1986, 2 | Krupcik, Cellar, et al., 1986, 2 | Habu, Flath, et al., 1985 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Packed |
---|---|---|---|
Active phase | OV-101 | SE-30 | Apiezon L |
Column length (m) | 50. | 50. | 2. |
Carrier gas | He | He | |
Substrate | Chromosorb G-AW-DMCS | ||
Column diameter (mm) | 0.31 | 0.5 | |
Phase thickness (μm) | |||
Tstart (C) | 0. | 40. | 25. |
Tend (C) | 225. | 170. | |
Heat rate (K/min) | 3. | 3. | 10. |
Initial hold (min) | 1. | 3. | |
Final hold (min) | |||
I | 841. | 845. | 842. |
Reference | del Rosario, de Lumen, et al., 1984 | Heydanek and McGorrin, 1981 | Dahlmann, Köser, et al., 1979 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane 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.
Bramston-Cook, 2013
Bramston-Cook, R.,
Kovats indices for C2-C13 hydrocarbons and selected oxygenated/halocarbons with 100 % dimethylpolysiloxane columns, 2013, retrieved from http://lotusinstruments.com/monographs/List .... [all data]
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Supelco, 2012
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Volatile constituents of the giant pufball mushroom (Calvatia gigantea),
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Notes
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References
- Symbols used in this document:
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