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indole-3-butyric acid, methyl ester
SpectraBase Compound ID L9KNRIOrMYl
InChI InChI=1S/C13H15NO2/c1-16-13(15)8-4-5-10-9-14-12-7-3-2-6-11(10)12/h2-3,6-7,9,14H,4-5,8H2,1H3
InChIKey ZEJUFCOACOWDPP-UHFFFAOYSA-N
Mol Weight 217.27 g/mol
Molecular Formula C13H15NO2
Exact Mass 217.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LKKRupnEX9d
Name 1H-Indole-3-butanoic acid, methyl ester
CAS Registry Number 15591-70-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2
InChI InChI=1S/C13H15NO2/c1-16-13(15)8-4-5-10-9-14-12-7-3-2-6-11(10)12/h2-3,6-7,9,14H,4-5,8H2,1H3
InChIKey ZEJUFCOACOWDPP-UHFFFAOYSA-N
Molecular Weight 217.268 g/mol
SMILES C(=O)(CCCc1c2c(cccc2)[nH]c1)OC
SPLASH splash10-001i-9710000000-bbf722eb411a09ef94ed
Source of Spectrum AD-0-5057-0
Synonyms 4-(1H-indol-3-yl)butanoic acid methyl ester Methyl 4-(1H-indol-3-yl)butanoate 4-(1H-indol-3-yl)butyric acid methyl ester Indole-3-butyric acid, methyl ester Methyl 4-(indol-3-yl)butyrate Methyl ester of 3-Indolebutyric acid Methyl indole-3-butyrate EINECS 239-658-0
Wiley ID 27636