For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

anti-(1R,3S)-1-Mercapto-1-phenyl-3-hexanol

View entire compound with spectra: 1 MS (GC)

anti-(1R,3S)-1-Mercapto-1-phenyl-3-hexanol
SpectraBase Compound ID DeBbUZo2trY
InChI InChI=1S/C12H18OS/c1-2-6-11(13)9-12(14)10-7-4-3-5-8-10/h3-5,7-8,11-14H,2,6,9H2,1H3/t11-,12+/m0/s1
InChIKey KYOYXCGTTAEYNQ-NWDGAFQWSA-N
Mol Weight 210.33 g/mol
Molecular Formula C12H18OS
Exact Mass 210.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3py3dnrQbvl
Name anti-(1R,3S)-1-Mercapto-1-phenyl-3-hexanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18OS
InChI InChI=1S/C12H18OS/c1-2-6-11(13)9-12(14)10-7-4-3-5-8-10/h3-5,7-8,11-14H,2,6,9H2,1H3/t11-,12+/m0/s1
InChIKey KYOYXCGTTAEYNQ-NWDGAFQWSA-N
Molecular Weight 210.335 g/mol
SMILES O[C@](C[C@](c1ccccc1)(S)[H])(CCC)[H]
SPLASH splash10-0a4i-0900000000-3721f0fef6f4ca5626b6
Source of Spectrum KD-15-903-3
Synonyms (1R,3S)-1-phenyl-1-sulfanyl-3-hexanol
Wiley ID 1636838