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(E)-2-(2-butoxyanilino)-4-(4-methylphenyl)-4-oxo-2-butenoic acid
SpectraBase Compound ID llAqxSdpge
InChI InChI=1S/C21H23NO4/c1-3-4-13-26-20-8-6-5-7-17(20)22-18(21(24)25)14-19(23)16-11-9-15(2)10-12-16/h5-12,14,22H,3-4,13H2,1-2H3,(H,24,25)/b18-14+
InChIKey MOMAVBDWZFQOLR-NBVRZTHBSA-N
Mol Weight 353.42 g/mol
Molecular Formula C21H23NO4
Exact Mass 353.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4zBlOY0oB1E
Name (E)-2-(2-butoxyanilino)-4-(4-methylphenyl)-4-oxo-2-butenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO4
InChI InChI=1S/C21H23NO4/c1-3-4-13-26-20-8-6-5-7-17(20)22-18(21(24)25)14-19(23)16-11-9-15(2)10-12-16/h5-12,14,22H,3-4,13H2,1-2H3,(H,24,25)/b18-14+
InChIKey MOMAVBDWZFQOLR-NBVRZTHBSA-N
Molecular Weight 353.418 g/mol
SMILES N(\C(C(=O)O)=C\C(c1ccc(cc1)C)=O)c1c(OCCCC)cccc1
SPLASH splash10-014l-9512000000-250a7283c63ffea0e820
Synonyms (E)-2-(2-butoxyanilino)-4-(4-methylphenyl)-4-oxobut-2-enoic acid (E)-2-(2-butoxyanilino)-4-keto-4-(p-tolyl)but-2-enoic acid (E)-2-(2-butoxyanilino)-4-oxo-4-(p-tolyl)but-2-enoic acid (E)-2-[(2-butoxyphenyl)amino]-4-(4-methylphenyl)-4-oxidanylidene-but-2-enoic acid 2-(2-Butoxyanilino)-4-(4-methylphenyl)-4-oxo-2-butenoic acid
Wiley ID 1443815