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S-methyl 3-chlorobenzothioate
SpectraBase Compound ID IXwvPDN3NVM
InChI InChI=1S/C8H7ClOS/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3
InChIKey XLUGDMFAGSZFOM-UHFFFAOYSA-N
Mol Weight 186.66 g/mol
Molecular Formula C8H7ClOS
Exact Mass 185.990614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8XaAbDp16IY
Name S-methyl 3-chlorobenzenecarbothioate
Alternate Name(s) 3-Chlorobenzenecarbothioic acid S-methyl ester S-methyl 3-chloranylbenzenecarbothioate
CAS Registry Number 28145-57-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClOS
InChI InChI=1S/C8H7ClOS/c1-11-8(10)6-3-2-4-7(9)5-6/h2-5H,1H3
InChIKey XLUGDMFAGSZFOM-UHFFFAOYSA-N
Molecular Weight 186.656 g/mol
SMILES C(c1cc(Cl)ccc1)(=O)SC
SPLASH splash10-0a6r-3900000000-06b004e315cd6996a56a
Source of Spectrum O-3-2623-0
Wiley ID 1182320