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4-Chlorobenzenecarbothioic acid S-(cyclohexylthio) ester
SpectraBase Compound ID G7yJij7Zfyw
InChI InChI=1S/C13H15ClOS2/c14-11-8-6-10(7-9-11)13(15)17-16-12-4-2-1-3-5-12/h6-9,12H,1-5H2
InChIKey QDUFIJIMYNBWLZ-UHFFFAOYSA-N
Mol Weight 286.84 g/mol
Molecular Formula C13H15ClOS2
Exact Mass 286.025285 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DNyoRLrvwQy
Name 4-Chlorobenzenecarbothioic acid S-(cyclohexylthio) ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15ClOS2
InChI InChI=1S/C13H15ClOS2/c14-11-8-6-10(7-9-11)13(15)17-16-12-4-2-1-3-5-12/h6-9,12H,1-5H2
InChIKey QDUFIJIMYNBWLZ-UHFFFAOYSA-N
Molecular Weight 286.835 g/mol
SMILES C(SSC1CCCCC1)(c1ccc(cc1)Cl)=O
SPLASH splash10-000i-0900000000-81c17f504f13d19f76fd
Source of Spectrum SO-0-1039-5
Synonyms 4-Chlorothiobenzoic acid S-(cyclohexylthio) ester S-cyclohexylsulfanyl 4-chloranylbenzenecarbothioate S-cyclohexylsulfanyl 4-chlorobenzenecarbothioate
Wiley ID 864425