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alpha-(4-Nitrobenzamido)-2,4,5-trimethoxycinnamic acid
SpectraBase Compound ID 3Lgu1NSY6NZ
InChI InChI=1S/C19H18N2O8/c1-27-15-10-17(29-3)16(28-2)9-12(15)8-14(19(23)24)20-18(22)11-4-6-13(7-5-11)21(25)26/h4-10H,1-3H3,(H,20,22)(H,23,24)/b14-8-
InChIKey JXSQPPONZMCKQV-ZSOIEALJSA-N
Mol Weight 402.36 g/mol
Molecular Formula C19H18N2O8
Exact Mass 402.106316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BgaPBH4P0D4
Name alpha-(4-Nitrobenzamido)-2,4,5-trimethoxycinnamic acid
Alternate Name(s) (Z)-2-(4-nitrobenzamido)-3-(2,4,5-trimethoxyphenyl)acrylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N2O8
InChI InChI=1S/C19H18N2O8/c1-27-15-10-17(29-3)16(28-2)9-12(15)8-14(19(23)24)20-18(22)11-4-6-13(7-5-11)21(25)26/h4-10H,1-3H3,(H,20,22)(H,23,24)/b14-8-
InChIKey JXSQPPONZMCKQV-ZSOIEALJSA-N
Literature Reference DOI 10.1002/rcm.1867
Molecular Weight 402.359 g/mol
SMILES OC(\C(=C\c1cc(c(cc1OC)OC)OC)NC(=O)c1ccc(cc1)[N+]([O-])=O)=O
SPLASH splash10-0pb9-0898700000-f9cf7277c1582779c354
Source of Spectrum RCM-19-956-12
Wiley ID 1820228