(Z)-Hex-3-enyl 3-chlorobenzoate
- Formula: C13H15ClO2
- Molecular weight: 238.710
- IUPAC Standard InChI: InChI=1S/C13H15ClO2/c1-2-3-4-5-9-16-13(15)11-7-6-8-12(14)10-11/h3-4,6-8,10H,2,5,9H2,1H3/b4-3-
- IUPAC Standard InChIKey: PSTUDEYXVHRFJN-ARJAWSKDSA-N
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: Benzoic acid, 3-chloro, (Z)-3-hexenyl ester
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Gas Chromatography
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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
Kovats' RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | SE-30 | 140. | 1695. | Korhonen and Lind, 1985 | |
| Capillary | SE-30 | 160. | 1706. | Korhonen and Lind, 1985 | |
| Capillary | SE-30 | 200. | 1715. | Korhonen and Lind, 1985 |
Kovats' RI, polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Capillary | OV-351 | 140. | 2276. | Korhonen and Lind, 1985 | N2; Column length: 25. m; Column diameter: 0.32 mm |
| Capillary | OV-351 | 160. | 2298. | Korhonen and Lind, 1985 | N2; Column length: 25. m; Column diameter: 0.32 mm |
| Capillary | OV-351 | 180. | 2319. | Korhonen and Lind, 1985 | N2; Column length: 25. m; Column diameter: 0.32 mm |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | VF-5MS | 1751. | Liang, 2010 | 30. m/0.25 mm/0.25 μm, He; Tstart: 60. C; Tend: 270. C |
| Capillary | SE-30 | 1724. | Korhonen and Lind, 1985 | 10. K/min; Tstart: 100. C; Tend: 280. C |
| Capillary | SE-30 | 1701. | Korhonen and Lind, 1985 | 2. K/min; Tstart: 100. C; Tend: 280. C |
| Capillary | SE-30 | 1715. | Korhonen and Lind, 1985 | 6. K/min; Tstart: 100. C; Tend: 280. C |
Van Den Dool and Kratz RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | OV-351 | 2335. | Korhonen and Lind, 1985 | N2, 10. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 100. C; Tend: 230. C |
| Capillary | OV-351 | 2306. | Korhonen and Lind, 1985 | N2, 2. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 100. C; Tend: 230. C |
| Capillary | OV-351 | 2318. | Korhonen and Lind, 1985 | N2, 6. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 100. C; Tend: 230. C |
References
Go To: Top, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Korhonen and Lind, 1985
Korhonen, I.O.O.; Lind, M.A.,
Gas-liquid chromatographic analyses. XXXVIII. Capillary column studies of unsaturated esters of benzoic and monochlorobenzoic acids,
J. Chromatogr., 1985, 324, 113-127, https://doi.org/10.1016/S0021-9673(01)81311-X
. [all data]
Liang, 2010
Liang, Y.,
Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2010. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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