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Methyl 3-[(2-aminophenyl)sulfanyl]butanoate
SpectraBase Compound ID RKprFIQMv5
InChI InChI=1S/C11H15NO2S/c1-8(7-11(13)14-2)15-10-6-4-3-5-9(10)12/h3-6,8H,7,12H2,1-2H3
InChIKey VEFXMQXUCMEEML-UHFFFAOYSA-N
Mol Weight 225.31 g/mol
Molecular Formula C11H15NO2S
Exact Mass 225.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9eYgQxZzedN
Name Methyl 3-[(2-aminophenyl)sulfanyl]butanoate
CAS Registry Number 98186-24-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO2S
InChI InChI=1S/C11H15NO2S/c1-8(7-11(13)14-2)15-10-6-4-3-5-9(10)12/h3-6,8H,7,12H2,1-2H3
InChIKey VEFXMQXUCMEEML-UHFFFAOYSA-N
Molecular Weight 225.306 g/mol
SMILES Nc1c(cccc1)SC(C)CC(=O)OC
SPLASH splash10-00di-9710000000-cc2f16862103ba06b989
Synonyms 3-[(2-aminophenyl)thio]butanoic acid methyl ester 3-[(2-aminophenyl)thio]butyric acid methyl ester Butanoic acid, 3-[(2-aminophenyl)thio]-, methyl ester
Wiley ID 1486888