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3-Chlorobenzenecarbothioic acid O-ethyl ester
SpectraBase Compound ID 6AHtwtqqbrL
InChI InChI=1S/C9H9ClOS/c1-2-11-9(12)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3
InChIKey NSOLQKMOGRHUCD-UHFFFAOYSA-N
Mol Weight 200.68 g/mol
Molecular Formula C9H9ClOS
Exact Mass 200.006264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ChODoRhvNbk
Name 3-Chlorobenzenecarbothioic acid O-ethyl ester
Alternate Name(s) 3-Chlorothiobenzoic acid O-ethyl ester O-ethyl 3-chloranylbenzenecarbothioate O-ethyl 3-chlorobenzenecarbothioate
CAS Registry Number 13806-78-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9ClOS
InChI InChI=1S/C9H9ClOS/c1-2-11-9(12)7-4-3-5-8(10)6-7/h3-6H,2H2,1H3
InChIKey NSOLQKMOGRHUCD-UHFFFAOYSA-N
Molecular Weight 200.683 g/mol
SMILES C(c1cc(Cl)ccc1)(=S)OCC
SPLASH splash10-0kmi-2930000000-b187c9dfbd7c49769c96
Source of Spectrum O-3-2622-0
Wiley ID 1197195