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

*Links on SpectraBase are not permalinks.
(1S,2S)-1,2-Dihydroxy-3-(methylthio)-4-fluorocyclohexa-3,5-diene
SpectraBase Compound ID Ai7zDLONKzt
InChI InChI=1S/C7H9FO2S/c1-11-7-4(8)2-3-5(9)6(7)10/h2-3,5-6,9-10H,1H3/t5-,6-/m0/s1
InChIKey UBFOGMFKZFIMCS-WDSKDSINSA-N
Mol Weight 176.21 g/mol
Molecular Formula C7H9FO2S
Exact Mass 176.030729 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 6mJkvrUABoB
Name (1S,2S)-1,2-Dihydroxy-3-(methylthio)-4-fluorocyclohexa-3,5-diene
Alternate Name(s) (1S,2S)-4-fluoro-3-(methylthio)cyclohexa-3,5-diene-1,2-diol (1S,2S)-4-fluoro-3-methylsulfanylcyclohexa-3,5-diene-1,2-diol (1S,2S)-4-fluoro-3-methylsulfanyl-cyclohexa-3,5-diene-1,2-diol (1S,2S)-4-fluoranyl-3-methylsulfanyl-cyclohexa-3,5-diene-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H9FO2S
InChI InChI=1S/C7H9FO2S/c1-11-7-4(8)2-3-5(9)6(7)10/h2-3,5-6,9-10H,1H3/t5-,6-/m0/s1
InChIKey UBFOGMFKZFIMCS-WDSKDSINSA-N
Molecular Weight 176.205 g/mol
SMILES O[C@]1([C@](C=CC(=C1SC)F)(O)[H])[H]
SPLASH splash10-0a4l-0900000000-2e3697bc9f70a6720748
Source of Spectrum F5-2-2536-31
Wiley ID 1732035