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benzenecarbothioic acid S-(2-hydroxycyclopentyl) ester

View entire compound with spectra: 1 MS (GC)

benzenecarbothioic acid S-(2-hydroxycyclopentyl) ester
SpectraBase Compound ID 1Rug2dWtCxR
InChI InChI=1S/C12H14O2S/c13-10-7-4-8-11(10)15-12(14)9-5-2-1-3-6-9/h1-3,5-6,10-11,13H,4,7-8H2
InChIKey WVNJNUZWWBOEAA-UHFFFAOYSA-N
Mol Weight 222.3 g/mol
Molecular Formula C12H14O2S
Exact Mass 222.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ki9ZJwGZTo1
Name benzenecarbothioic acid S-(2-hydroxycyclopentyl) ester
CAS Registry Number 93604-41-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O2S
InChI InChI=1S/C12H14O2S/c13-10-7-4-8-11(10)15-12(14)9-5-2-1-3-6-9/h1-3,5-6,10-11,13H,4,7-8H2
InChIKey WVNJNUZWWBOEAA-UHFFFAOYSA-N
Molecular Weight 222.302 g/mol
SMILES OC1C(SC(=O)c2ccccc2)CCC1
SPLASH splash10-0a5i-9300000000-f3cb1d8895a24676ac6f
Source of Spectrum J-50-298-11
Synonyms S-(2-hydroxycyclopentyl) benzenecarbothioate S-(2-oxidanylcyclopentyl) benzenecarbothioate thiobenzoic acid S-(2-hydroxycyclopentyl) ester
Wiley ID 1222130