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1H-Pyrrole-3-propanoic acid, 4-methyl-2-[(phenylmethoxy)carbonyl]-, phenylmethyl ester
SpectraBase Compound ID 1hU6zBCGI9z
InChI InChI=1S/C23H23NO4/c1-17-14-24-22(23(26)28-16-19-10-6-3-7-11-19)20(17)12-13-21(25)27-15-18-8-4-2-5-9-18/h2-11,14,24H,12-13,15-16H2,1H3
InChIKey VLRMRWFRQCDQPQ-UHFFFAOYSA-N
Mol Weight 377.44 g/mol
Molecular Formula C23H23NO4
Exact Mass 377.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J2VoWvAvoM
Name 1H-Pyrrole-3-propanoic acid, 4-methyl-2-[(phenylmethoxy)carbonyl]-, phenylmethyl ester
CAS Registry Number 51742-43-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H23NO4
InChI InChI=1S/C23H23NO4/c1-17-14-24-22(23(26)28-16-19-10-6-3-7-11-19)20(17)12-13-21(25)27-15-18-8-4-2-5-9-18/h2-11,14,24H,12-13,15-16H2,1H3
InChIKey VLRMRWFRQCDQPQ-UHFFFAOYSA-N
Molecular Weight 377.440 g/mol
SMILES [nH]1cc(c(c1C(OCc1ccccc1)=O)CCC(=O)OCc1ccccc1)C
SPLASH splash10-0006-9001000000-cb5cbd9f99c27474be35
Source of Spectrum KC-1985-1702-0
Synonyms Benzyl 3-(2-benzyloxycarbonylethyl)-4-methylpyrrole-2-carboxylate benzyl 3-[3-(benzyloxy)-3-oxopropyl]-4-methyl-1H-pyrrole-2-carboxylate
Wiley ID 1358323