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Carbamic acid, [2-[[3-[5-[(3-ethyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-2-formyl-4-methyl-1H-pyrrol-3-yl]-1-oxopropyl]amino]ethyl]-, phenylmethyl ester, (Z)-
SpectraBase Compound ID Dybq4zdaE6T
InChI InChI=1S/C27H32N4O5/c1-4-20-18(3)26(34)31-23(20)14-22-17(2)21(24(15-32)30-22)10-11-25(33)28-12-13-29-27(35)36-16-19-8-6-5-7-9-19/h5-9,14-15,30H,4,10-13,16H2,1-3H3,(H,28,33)(H,29,35)(H,31,34)/b23-14-
InChIKey LPZWTCFYXLELBF-UCQKPKSFSA-N
Mol Weight 492.6 g/mol
Molecular Formula C27H32N4O5
Exact Mass 492.23727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KEsM0OAuKKs
Name Carbamic acid, [2-[[3-[5-[(3-ethyl-1,5-dihydro-4-methyl-5-oxo-2H-pyrrol-2-ylidene)methyl]-2-formyl-4-methyl-1H-pyrrol-3-yl]-1-oxopropyl]amino]ethyl]-, phenylmethyl ester, (Z)-
CAS Registry Number 129112-00-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H32N4O5
InChI InChI=1S/C27H32N4O5/c1-4-20-18(3)26(34)31-23(20)14-22-17(2)21(24(15-32)30-22)10-11-25(33)28-12-13-29-27(35)36-16-19-8-6-5-7-9-19/h5-9,14-15,30H,4,10-13,16H2,1-3H3,(H,28,33)(H,29,35)(H,31,34)/b23-14-
InChIKey LPZWTCFYXLELBF-UCQKPKSFSA-N
Molecular Weight 492.576 g/mol
SMILES N1C(C(=C(\C1=C/c1c(c(CCC(=O)NCCNC(=O)OCc2ccccc2)c([nH]1)C=O)C)CC)C)=O
SPLASH splash10-0006-8229600000-78d63db891220196e18a
Source of Spectrum AH-121-216-8
Synonyms 2,7-Dimethyl-3-ethyl-9-formyl-dipyrrinone-8-(benzyloxycarbonyl-aminoethyl)-propylamide benzyl 2-[(3-{5-[(Z)-(3-ethyl-4-methyl-5-oxo-1,5-dihydro-2H-pyrrol-2-ylidene)methyl]-2-formyl-4-methyl-1H-pyrrol-3-yl}propanoyl)amino]ethylcarbamate
Wiley ID 1397554