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

*Links on SpectraBase are not permalinks.
2-Thiabicyclo[2.2.2]octan-5-one, 8-hydroxy-1,3,8-trimethyl-
SpectraBase Compound ID 5unrByypUKu
InChI InChI=1S/C10H16O2S/c1-6-8-7(11)4-9(2,13-6)5-10(8,3)12/h6,8,12H,4-5H2,1-3H3/t6?,8-,9+,10-/m1/s1
InChIKey WVBMTQHSHWRRAA-HJMCRLAHSA-N
Mol Weight 200.3 g/mol
Molecular Formula C10H16O2S
Exact Mass 200.087101 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 BXi8BfKoBsv
Name 2-Thiabicyclo[2.2.2]octan-5-one, 8-hydroxy-1,3,8-trimethyl-
CAS Registry Number 57274-39-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2S
InChI InChI=1S/C10H16O2S/c1-6-8-7(11)4-9(2,13-6)5-10(8,3)12/h6,8,12H,4-5H2,1-3H3/t6?,8-,9+,10-/m1/s1
InChIKey WVBMTQHSHWRRAA-HJMCRLAHSA-N
Molecular Weight 200.296 g/mol
SMILES O[C@@]1(C[C@]2(C)CC(=O)[C@]1(C(S2)C)[H])C
SPLASH splash10-00kf-9510000000-7afb366b3d85a99222a8
Source of Spectrum EP-7843-0-0
Synonyms 8-Hydroxy-1,3,8-trimethyl-2-thiabicyclo[2.2.2]octan-5-one 2,4,7-trimethyl-2-oxidanyl-8-thiabicyclo[2.2.2]octan-6-one 2-Hydroxy-2,4,7-trimethyl-8-thiabicyclo[2.2.2]octan-6-one
Wiley ID 1197359