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S-Methyl 3-oxo-3-(p-tolyl)propanethioate
SpectraBase Compound ID 1oRsf1PsJvn
InChI InChI=1S/C11H12O2S/c1-8-3-5-9(6-4-8)10(12)7-11(13)14-2/h3-6H,7H2,1-2H3
InChIKey DSFPGXCOEQVSOS-UHFFFAOYSA-N
Mol Weight 208.27 g/mol
Molecular Formula C11H12O2S
Exact Mass 208.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A3KnOL5oFvm
Name S-Methyl 3-oxo-3-(p-tolyl)propanethioate
Alternate Name(s) S-methyl 3-(4-methylphenyl)-3-oxopropanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2S
InChI InChI=1S/C11H12O2S/c1-8-3-5-9(6-4-8)10(12)7-11(13)14-2/h3-6H,7H2,1-2H3
InChIKey DSFPGXCOEQVSOS-UHFFFAOYSA-N
Molecular Weight 208.275 g/mol
SMILES C(C(c1ccc(cc1)C)=O)C(=O)SC
SPLASH splash10-014i-0900000000-00a6d12f17c016f93931
Source of Spectrum SK-31-1458-2
Wiley ID 882019