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(1S,8S)-8-(4-chlorophenylthio)cyclooct-4-enol
SpectraBase Compound ID 77uzpl9Q2U0
InChI InChI=1S/C14H17ClOS/c15-11-7-9-12(10-8-11)17-14-6-4-2-1-3-5-13(14)16/h1-2,7-10,13-14,16H,3-6H2/b2-1-/t13-,14-/m0/s1
InChIKey BYESKWGGZHITON-GFCAHOMWSA-N
Mol Weight 268.8 g/mol
Molecular Formula C14H17ClOS
Exact Mass 268.068864 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9aFgCbPpG88
Name (1S,8S)-8-(4-chlorophenylthio)cyclooct-4-enol
Alternate Name(s) (1S,8S,Z)-8-((4-chlorophenyl)thio)cyclooct-4-enol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClOS
InChI InChI=1S/C14H17ClOS/c15-11-7-9-12(10-8-11)17-14-6-4-2-1-3-5-13(14)16/h1-2,7-10,13-14,16H,3-6H2/b2-1-/t13-,14-/m0/s1
InChIKey BYESKWGGZHITON-GFCAHOMWSA-N
Literature Reference DOI 10.1002/adsc.200800767
Molecular Weight 268.802 g/mol
SMILES O[C@]1(CC\C=C/CC[C@@]1(Sc1ccc(cc1)Cl)[H])[H]
SPLASH splash10-03di-0900000000-12ee0500475af7cc7c3e
Source of Spectrum ASC-351-920/SM8-20n
Wiley ID 1766480