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S-methyl 4-chlorobenzothioate
SpectraBase Compound ID 8l71cxYgYPi
InChI InChI=1S/C8H7ClOS/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey LTDZYPIYMPWKEC-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 HM5nilpw4xI
Name S-Methyl 4-chlorobenzothioate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H7ClOS
InChI InChI=1S/C8H7ClOS/c1-11-8(10)6-2-4-7(9)5-3-6/h2-5H,1H3
InChIKey LTDZYPIYMPWKEC-UHFFFAOYSA-N
Instrument Name Shimadzu 2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00665
Molecular Weight 186.656 g/mol
SMILES CSC(c1ccc(cc1)Cl)=O
SPLASH splash10-000i-2900000000-03f54a52897c5a24f7ce
Source of Spectrum JOC-86-8801-3j
Wiley ID 1867842