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(phenylmethyl) 4-ethanoyl-5-[(5-methoxycarbonyl-1H-pyrrol-2-yl)methyl]-3-methyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID DHhOJGVYvjE
InChI InChI=1S/C22H22N2O5/c1-13-19(14(2)25)18(11-16-9-10-17(23-16)21(26)28-3)24-20(13)22(27)29-12-15-7-5-4-6-8-15/h4-10,23-24H,11-12H2,1-3H3
InChIKey KMWUZQNJAXMRAX-UHFFFAOYSA-N
Mol Weight 394.43 g/mol
Molecular Formula C22H22N2O5
Exact Mass 394.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JyytPWXdKMg
Name (phenylmethyl) 4-ethanoyl-5-[(5-methoxycarbonyl-1H-pyrrol-2-yl)methyl]-3-methyl-1H-pyrrole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O5
InChI InChI=1S/C22H22N2O5/c1-13-19(14(2)25)18(11-16-9-10-17(23-16)21(26)28-3)24-20(13)22(27)29-12-15-7-5-4-6-8-15/h4-10,23-24H,11-12H2,1-3H3
InChIKey KMWUZQNJAXMRAX-UHFFFAOYSA-N
Molecular Weight 394.427 g/mol
SMILES [nH]1c(c(c(c1Cc1ccc([nH]1)C(=O)OC)C(=O)C)C)C(OCc1ccccc1)=O
SPLASH splash10-0f6x-9378000000-8b3cb6b71d6c6c5667e5
Source of Spectrum KC-0-1792-14
Synonyms 4-Acetyl-5-[(5-carbomethoxy-1H-pyrrol-2-yl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid benzyl ester 4-Acetyl-5-[(5-methoxycarbonyl-1H-pyrrol-2-yl)methyl]-3-methyl-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester
Wiley ID 786136