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Methyl 2-methyl-3-(p-tolylsulfonyl)propanoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Methyl 2-methyl-3-(p-tolylsulfonyl)propanoate
SpectraBase Compound ID AzegySdokZD
InChI InChI=1S/C12H16O4S/c1-9-4-6-11(7-5-9)17(14,15)8-10(2)12(13)16-3/h4-7,10H,8H2,1-3H3
InChIKey ABJISGAJTYFARS-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C12H16O4S
Exact Mass 256.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7BfQ6qq2jPi
Name Methyl 2-Methyl-3-(p-tolylsulfonyl)propanoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4S
InChI InChI=1S/C12H16O4S/c1-9-4-6-11(7-5-9)17(14,15)8-10(2)12(13)16-3/h4-7,10H,8H2,1-3H3
InChIKey ABJISGAJTYFARS-UHFFFAOYSA-N
Molecular Weight 256.316 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(C(=O)OC)C
SPLASH splash10-0k96-9600000000-03770f52357318dac9f1
Source of Spectrum AJ-64-3604-2
Synonyms 2-Methyl-3-(4-methylphenyl)sulfonylpropanoic acid methyl ester 2-Methyl-3-tosyl-propionic acid methyl ester Methyl 2-methyl-3-(4-methylphenyl)sulfonylpropanoate
Wiley ID 1259397