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ethyl [1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate
SpectraBase Compound ID K8SIsZAsOb7
InChI InChI=1S/C14H17NO2S/c1-4-17-13(16)9-12-14(18-3)10-7-5-6-8-11(10)15(12)2/h5-8H,4,9H2,1-3H3
InChIKey YQRSRAUOGSMWMP-UHFFFAOYSA-N
Mol Weight 263.35 g/mol
Molecular Formula C14H17NO2S
Exact Mass 263.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3iTLcOLJz13
Name Ethyl [1-methyl-3-(methylsulfanyl)-1H-indol-2-yl]acetate
Alternate Name(s) 2-[1-methyl-3-(methylthio)-2-indolyl]acetic acid ethyl ester 2-[1-methyl-3-(methylthio)indol-2-yl]acetic acid ethyl ester Acetic acid, 2-(1-methyl-3-methylthio-2-indolyl)-, ethyl ester Ethyl 2-(1-methyl-3-methylsulfanyl-indol-2-yl)acetate Ethyl 2-(1-methyl-3-methylsulfanyl-indol-2-yl)ethanoate
CAS Registry Number 57666-04-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO2S
InChI InChI=1S/C14H17NO2S/c1-4-17-13(16)9-12-14(18-3)10-7-5-6-8-11(10)15(12)2/h5-8H,4,9H2,1-3H3
InChIKey YQRSRAUOGSMWMP-UHFFFAOYSA-N
Molecular Weight 263.355 g/mol
SMILES c1([n](c2ccccc2c1SC)C)CC(=O)OCC
SPLASH splash10-03dl-2960000000-3febcc950c70ce9ec90f
Source of Spectrum AD-0-2532-0
Wiley ID 1425358