Hexane-3-thiol, 1-methoxy
- Formula: C7H16OS
- Molecular weight: 148.266
- IUPAC Standard InChI: InChI=1S/C7H16OS/c1-3-4-7(9)5-6-8-2/h7,9H,3-6H2,1-2H3
- IUPAC Standard InChIKey: GTDLILFCRHJTRW-UHFFFAOYSA-N
- CAS Registry Number: 94291-50-6
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: 1-Methoxyhexane-3-thiol; (+/-)-1-Methoxyheptane-3-thiol
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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, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | SPB-1 | 1140. | van de Waal, Niclass, et al., 2002 | 30. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 5. K/min, 240. C @ 20. min |
| Capillary | SPB-1 | 1041. | van de Waal, Niclass, et al., 2002 | 30. m/0.25 mm/0.25 μm, He, 50. C @ 5. min, 5. K/min, 240. C @ 20. min |
Normal alkane RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Supelcowax-20M | 1458. | van de Waal, Niclass, et al., 2002 | 50. C @ 5. min, 5. K/min, 240. C @ 20. min |
| Capillary | Supelcowax-20M | 1360. | van de Waal, Niclass, et al., 2002 | 50. C @ 5. min, 5. K/min, 240. C @ 20. min |
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.
van de Waal, Niclass, et al., 2002
van de Waal, M.; Niclass, Y.; Snowden, R.L.; Bernardinelli, G.; Escher, S.,
1-Methoxyhexane-3-thiol, a powerful odorant of clary sage (Salvia sclarea L.),
Helv. Chim. Acta, 2002, 85, 5, 1246-1260, https://doi.org/10.1002/1522-2675(200205)85:5<1246::AID-HLCA1246>3.0.CO;2-O
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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