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Methyl 4-((methylthio)carbonyl)benzoate
SpectraBase Compound ID AITJRLNfIqw
InChI InChI=1S/C10H10O3S/c1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h3-6H,1-2H3
InChIKey UEIQRHHIIKIQTQ-UHFFFAOYSA-N
Mol Weight 210.25 g/mol
Molecular Formula C10H10O3S
Exact Mass 210.035065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CGSQV8Oj5Pk
Name Methyl 4-((methylthio)carbonyl)benzoate
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O3S
InChI InChI=1S/C10H10O3S/c1-13-9(11)7-3-5-8(6-4-7)10(12)14-2/h3-6H,1-2H3
InChIKey UEIQRHHIIKIQTQ-UHFFFAOYSA-N
Instrument Name Shimadzu 2010
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00665
Molecular Weight 210.247 g/mol
Reported Formula C10H10O3S
SMILES COC(c1ccc(cc1)C(=O)SC)=O
SPLASH splash10-03di-2900000000-cb046548ee971ed16687
Source of Spectrum JOC-86-8801-3n
Wiley ID 1867846