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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 5imAFvnOYtD
Name S-methyl 3-chlorobenzothioate
Appearance Light yellow liquid
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
Instrument Name Shimadzu-QP2010
Ionization Type EI
Literature Reference DOI 10.1002/ajoc.202000520
Molecular Weight 186.656 g/mol
Reported Formula C8H7ClOS
SMILES c1c(cc(cc1)C(=O)SC)Cl
SPLASH splash10-000i-2900000000-e866a55eccd580f040a6
Source of Spectrum AJO-9-SM37-12a
Wiley ID 1855691