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Benzoic acid,4-[2,5-dimethyl-3-(4-methyl-3-nitrophenyl)iminomethyl-1-pyrrolyl],ethyl ester-
SpectraBase Compound ID GXdAu11OA7P
InChI InChI=1S/C23H23N3O4/c1-5-30-23(27)18-7-10-21(11-8-18)25-16(3)12-19(17(25)4)14-24-20-9-6-15(2)22(13-20)26(28)29/h6-14H,5H2,1-4H3/b24-14+
InChIKey JPZSBOKZNDIKNH-ZVHZXABRSA-N
Mol Weight 405.45 g/mol
Molecular Formula C23H23N3O4
Exact Mass 405.168856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BlNKRczGdql
Name Benzoic acid,4-[2,5-dimethyl-3-(4-methyl-3-nitrophenyl)iminomethyl-1-pyrrolyl],ethyl ester-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23N3O4
InChI InChI=1S/C23H23N3O4/c1-5-30-23(27)18-7-10-21(11-8-18)25-16(3)12-19(17(25)4)14-24-20-9-6-15(2)22(13-20)26(28)29/h6-14H,5H2,1-4H3/b24-14+
InChIKey JPZSBOKZNDIKNH-ZVHZXABRSA-N
Molecular Weight 405.454 g/mol
SMILES c1c(cc(c(c1)C)N(=O)=O)\N=C\c1c([n](c(c1)C)-c1ccc(cc1)C(OCC)=O)C
SPLASH splash10-0a4i-2645900000-495ba524bf20957e1c90
Synonyms Ethyl 4-(2,5-dimethyl-3-{(E)-[(4-methyl-3-nitrophenyl)imino]methyl}-1H-pyrrol-1-yl)benzoate Ethyl 4-(2,5-dimethyl-3-{[(4-methyl-3-nitrophenyl)imino]methyl}-1H-pyrrol-1-yl)benzoate
Wiley ID 1444673