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1H-Pyrrole-3-carboxylic acid, 5-(3-benzyloxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-, methyl ester
SpectraBase Compound ID 2ZPPkBoXyYJ
InChI InChI=1S/C21H19NO4/c1-14-19(21(24)25-2)20(23)18(22-14)12-16-9-6-10-17(11-16)26-13-15-7-4-3-5-8-15/h3-12,22H,13H2,1-2H3/b18-12+
InChIKey XMYRYESEMOVBQX-LDADJPATSA-N
Mol Weight 349.39 g/mol
Molecular Formula C21H19NO4
Exact Mass 349.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsqjV3GEC6F
Name 1H-Pyrrole-3-carboxylic acid, 5-(3-benzyloxybenzylidene)-2-methyl-4-oxo-4,5-dihydro-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19NO4
InChI InChI=1S/C21H19NO4/c1-14-19(21(24)25-2)20(23)18(22-14)12-16-9-6-10-17(11-16)26-13-15-7-4-3-5-8-15/h3-12,22H,13H2,1-2H3/b18-12+
InChIKey XMYRYESEMOVBQX-LDADJPATSA-N
Molecular Weight 349.386 g/mol
SMILES N1\C(C(C(=C1C)C(=O)OC)=O)=C\c1cc(OCc2ccccc2)ccc1
SPLASH splash10-0006-9010000000-8b07cc09a4ba6716b0e6
Synonyms (5E)-2-methyl-4-oxo-5-[(3-phenylmethoxyphenyl)methylidene]-1H-pyrrole-3-carboxylic acid methyl ester (5E)-5-(3-benzoxybenzylidene)-4-keto-2-methyl-2-pyrroline-3-carboxylic acid methyl ester Methyl (5E)-2-methyl-4-oxidanylidene-5-[(3-phenylmethoxyphenyl)methylidene]-1H-pyrrole-3-carboxylate Methyl (5E)-2-methyl-4-oxo-5-[(3-phenylmethoxyphenyl)methylidene]-1H-pyrrole-3-carboxylate Methyl (5E)-5-[(3-benzyloxyphenyl)methylene]-2-methyl-4-oxo-1H-pyrrole-3-carboxylate Methyl (5E)-5-[3-(benzyloxy)benzylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Wiley ID 1439869