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2-Benzamido-3-(4-hydroxy-3-nitro-phenyl)propionic acid ethyl ester
SpectraBase Compound ID JEzzs1nI6MG
InChI InChI=1S/C18H18N2O6/c1-2-26-18(23)14(19-17(22)13-6-4-3-5-7-13)10-12-8-9-16(21)15(11-12)20(24)25/h3-9,11,14,21H,2,10H2,1H3,(H,19,22)
InChIKey AXBFOAFNNDCJGS-UHFFFAOYSA-N
Mol Weight 358.35 g/mol
Molecular Formula C18H18N2O6
Exact Mass 358.116486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3vaSsdM0AC7
Name 2-Benzamido-3-(4-hydroxy-3-nitro-phenyl)propionic acid ethyl ester
Alternate Name(s) 2-Benzamido-3-(4-hydroxy-3-nitrophenyl)propanoic acid ethyl ester Ethyl 2-benzamido-3-(3-nitro-4-oxidanyl-phenyl)propanoate Ethyl 2-benzamido-3-(4-hydroxy-3-nitro-phenyl)propanoate
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Formula C18H18N2O6
InChI InChI=1S/C18H18N2O6/c1-2-26-18(23)14(19-17(22)13-6-4-3-5-7-13)10-12-8-9-16(21)15(11-12)20(24)25/h3-9,11,14,21H,2,10H2,1H3,(H,19,22)
InChIKey AXBFOAFNNDCJGS-UHFFFAOYSA-N
Molecular Weight 358.350 g/mol
SMILES N(C(=O)c1ccccc1)C(Cc1cc(c(cc1)O)N(=O)=O)C(=O)OCC
SPLASH splash10-0a6r-3902000000-97037e77ce68ed23d76a
Source of Spectrum U1-2002-4015-6
Wiley ID 1523624