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2-[2-(4-aminophenyl)ethyl]pentanoic acid methyl ester
SpectraBase Compound ID IPmLeuA5y0S
InChI InChI=1S/C14H21NO2/c1-3-4-12(14(16)17-2)8-5-11-6-9-13(15)10-7-11/h6-7,9-10,12H,3-5,8,15H2,1-2H3
InChIKey MTMLFIITNDUGQB-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Izwqw2u55Wu
Name 2-[2-(4-aminophenyl)ethyl]pentanoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-3-4-12(14(16)17-2)8-5-11-6-9-13(15)10-7-11/h6-7,9-10,12H,3-5,8,15H2,1-2H3
InChIKey MTMLFIITNDUGQB-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES Nc1ccc(CCC(C(=O)OC)CCC)cc1
SPLASH splash10-052r-6910000000-24299950c2051bfdd444
Source of Spectrum J-63-8592-6
Synonyms 2-[2-(4-aminophenyl)ethyl]valeric acid methyl ester Methyl 2-[2-(4-aminophenyl)ethyl]pentanoate
Wiley ID 1237246