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(1S,2S)-2-(Phenylthio)-cyclooctanol
SpectraBase Compound ID Asn6YIdoOhx
InChI InChI=1S/C14H20OS/c15-13-10-6-1-2-7-11-14(13)16-12-8-4-3-5-9-12/h3-5,8-9,13-15H,1-2,6-7,10-11H2/t13-,14-/m0/s1
InChIKey DMOKYJFVYFADOO-KBPBESRZSA-N
Mol Weight 236.37 g/mol
Molecular Formula C14H20OS
Exact Mass 236.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HrkjEqE6j4
Name (1S,2S)-2-(Phenylthio)-cyclooctanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20OS
InChI InChI=1S/C14H20OS/c15-13-10-6-1-2-7-11-14(13)16-12-8-4-3-5-9-12/h3-5,8-9,13-15H,1-2,6-7,10-11H2/t13-,14-/m0/s1
InChIKey DMOKYJFVYFADOO-KBPBESRZSA-N
Literature Reference DOI 10.1002/adsc.200800767
Molecular Weight 236.373 g/mol
SMILES O[C@@]1([C@](CCCCCC1)(Sc1ccccc1)[H])[H]
SPLASH splash10-004i-9410000000-ee26f4a6c2a3e58993a0
Source of Spectrum ASC-351-920/SM7-20m
Synonyms (1S,2S)-2-(phenylthio)cyclooctanol
Wiley ID 1766479