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4-[2,5-dimethyl-3-(quinolin-8-yliminomethyl)-pyrrol-1-yl]-benzoic acid methyl ester
SpectraBase Compound ID JC4Bxm4LJxV
InChI InChI=1S/C24H21N3O2/c1-16-14-20(15-26-22-8-4-6-18-7-5-13-25-23(18)22)17(2)27(16)21-11-9-19(10-12-21)24(28)29-3/h4-15H,1-3H3/b26-15+
InChIKey MRZDAONNQKQFCV-CVKSISIWSA-N
Mol Weight 383.45 g/mol
Molecular Formula C24H21N3O2
Exact Mass 383.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62UW7CIUfcy
Name 4-[2,5-dimethyl-3-(quinolin-8-yliminomethyl)-pyrrol-1-yl]-benzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H21N3O2
InChI InChI=1S/C24H21N3O2/c1-16-14-20(15-26-22-8-4-6-18-7-5-13-25-23(18)22)17(2)27(16)21-11-9-19(10-12-21)24(28)29-3/h4-15H,1-3H3/b26-15+
InChIKey MRZDAONNQKQFCV-CVKSISIWSA-N
Molecular Weight 383.451 g/mol
SMILES c1cc2c(c(\N=C\c3c([n](c(c3)C)-c3ccc(C(=O)OC)cc3)C)ccc2)nc1
SPLASH splash10-004i-1901000000-7660bdaea72636186237
Synonyms Methyl 4-{2,5-dimethyl-3-[(8-quinolinylimino)methyl]-1H-pyrrol-1-yl}benzoate Methyl 4-{2,5-dimethyl-3-[(E)-(8-quinolinylimino)methyl]-1H-pyrrol-1-yl}benzoate
Wiley ID 1452662