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1H-Pyrrole-3-propanoic acid, 5-[(3-ethenyl-2,5-dihydro-4-methyl-5-oxo-1H-pyrrol-2-yl)methyl]-4-methyl-, methyl ester
SpectraBase Compound ID DIKQxcnIwXc
InChI InChI=1S/C17H22N2O3/c1-5-13-11(3)17(21)19-15(13)8-14-10(2)12(9-18-14)6-7-16(20)22-4/h5,9,15,18H,1,6-8H2,2-4H3,(H,19,21)
InChIKey MPURSLAVNPHDHO-UHFFFAOYSA-N
Mol Weight 302.37 g/mol
Molecular Formula C17H22N2O3
Exact Mass 302.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOBHWm7zdu6
Name 1H-Pyrrole-3-propanoic acid, 5-[(3-ethenyl-2,5-dihydro-4-methyl-5-oxo-1H-pyrrol-2-yl)methyl]-4-methyl-, methyl ester
CAS Registry Number 128670-83-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H22N2O3
InChI InChI=1S/C17H22N2O3/c1-5-13-11(3)17(21)19-15(13)8-14-10(2)12(9-18-14)6-7-16(20)22-4/h5,9,15,18H,1,6-8H2,2-4H3,(H,19,21)
InChIKey MPURSLAVNPHDHO-UHFFFAOYSA-N
Molecular Weight 302.374 g/mol
SMILES N1C(Cc2[nH]cc(c2C)CCC(=O)OC)C(=C(C1=O)C)C=C
SPLASH splash10-001i-0900000000-40b8312693a7759e5991
Source of Spectrum F-46-1053-10
Synonyms 4,5-Dihydro-2,7-dimethyl-8-(2-methoxycarbonylethyl)-3-vinyldipyrrin-1(1-h)-one Methyl 3-{4-methyl-5-[(4-methyl-5-oxo-3-vinyl-2,5-dihydro-1H-pyrrol-2-yl)methyl]-1H-pyrrol-3-yl}propanoate
Wiley ID 1304723