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Benzenecarbothioic acid, S-2-cyclopenten-1-yl ester
SpectraBase Compound ID 2CnxaT8efn9
InChI InChI=1S/C12H12OS/c13-12(10-6-2-1-3-7-10)14-11-8-4-5-9-11/h1-4,6-8,11H,5,9H2
InChIKey DPJTTZTYJVCSAU-UHFFFAOYSA-N
Mol Weight 204.29 g/mol
Molecular Formula C12H12OS
Exact Mass 204.060886 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYPSvUfUTkJ
Name Benzenecarbothioic acid, S-2-cyclopenten-1-yl ester
CAS Registry Number 117157-31-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12OS
InChI InChI=1S/C12H12OS/c13-12(10-6-2-1-3-7-10)14-11-8-4-5-9-11/h1-4,6-8,11H,5,9H2
InChIKey DPJTTZTYJVCSAU-UHFFFAOYSA-N
Molecular Weight 204.287 g/mol
SMILES C(SC1C=CCC1)(=O)c1ccccc1
SPLASH splash10-0a4i-0920000000-4080fab6c3b0c91f345c
Source of Spectrum KC-1988-581-5
Synonyms S-(2-cyclopenten-1-yl) benzenecarbothioate S-cyclopent-2-enyl thiobenzoate
Wiley ID 1201778