5-methyl-4-mercaptohexyl-2-acetate
- Formula: C9H18O2S
- Molecular weight: 190.303
- IUPAC Standard InChI: InChI=1S/C9H18O2S/c1-6(2)9(12)5-7(3)11-8(4)10/h6-7,9,12H,5H2,1-4H3
- IUPAC Standard InChIKey: XCOUODRDDWCWCD-UHFFFAOYSA-N
- Chemical structure:
This structure is also available as a 2d Mol file - Species with the same structure:
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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
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | CP Sil 5 CB | 1224. | Vermeulen and Collin, 2003 | 50. m/0.32 mm/1.2 μm, He; Program: 40C(4min) => 2C/min => 132C => 10C/min => 250C(45min) |
| Capillary | CP Sil 5 CB | 1238. | Vermeulen and Collin, 2003 | 50. m/0.32 mm/1.2 μm, He; Program: not specified |
Normal alkane RI, polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | FFAP | 1650. | Vermeulen and Collin, 2003 | 25. m/0.32 mm/0.3 μm; Program: 40C(4min) => 2C/min => 132C => 10C/min => 250C (15min) |
| Capillary | FFAP | 1675. | Vermeulen and Collin, 2003 | 25. m/0.32 mm/0.3 μm; Program: 40C(4min) => 2C/min => 132C => 10C/min => 250C (15min) |
References
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Vermeulen and Collin, 2003
Vermeulen, C.; Collin, S.,
Combinatorial synthesis and sensorial properties of 21 mercapto esters,
J. Agric. Food Chem., 2003, 51, 12, 3618-3622, https://doi.org/10.1021/jf021138z
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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