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1H-Pyrrole-3-propanoic acid, 2-[(1,1-dimethylethoxy)carbonyl]-5-[(3,3-dimethyl-5-oxo-2-pyrrolidinylidene)methyl]-4-(2-methoxy-2-oxoethyl)-, methyl ester, (Z)-
SpectraBase Compound ID ASrqcd1Dcmz
InChI InChI=1S/C23H32N2O7/c1-22(2,3)32-21(29)20-13(8-9-18(27)30-6)14(10-19(28)31-7)15(24-20)11-16-23(4,5)12-17(26)25-16/h11,24H,8-10,12H2,1-7H3,(H,25,26)/b16-11-
InChIKey ZBOWPEQMMLOXRE-WJDWOHSUSA-N
Mol Weight 448.5 g/mol
Molecular Formula C23H32N2O7
Exact Mass 448.220951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LjlQSvPYfXR
Name 1H-Pyrrole-3-propanoic acid, 2-[(1,1-dimethylethoxy)carbonyl]-5-[(3,3-dimethyl-5-oxo-2-pyrrolidinylidene)methyl]-4-(2-methoxy-2-oxoethyl)-, methyl ester, (Z)-
CAS Registry Number 113661-76-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32N2O7
InChI InChI=1S/C23H32N2O7/c1-22(2,3)32-21(29)20-13(8-9-18(27)30-6)14(10-19(28)31-7)15(24-20)11-16-23(4,5)12-17(26)25-16/h11,24H,8-10,12H2,1-7H3,(H,25,26)/b16-11-
InChIKey ZBOWPEQMMLOXRE-WJDWOHSUSA-N
Molecular Weight 448.516 g/mol
SMILES [nH]1c(\C=C/2NC(CC2(C)C)=O)c(c(CCC(=O)OC)c1C(OC(C)(C)C)=O)CC(=O)OC
SPLASH splash10-0006-0009100000-1b3eff2d741c2c0ca681
Source of Spectrum KC-1987-1677-48
Synonyms 5-[4-(2-methoxycarbonylethyl)-3-methoxycarbonylmethyl-5-t-butoxycarbonylpyrrol-2-ylmethylene]-4,4-dimethylpyrrolidin-2-one tert-Butyl 5-[(Z)-(3,3-dimethyl-5-oxo-2-pyrrolidinylidene)methyl]-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylate
Wiley ID 1387126