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1H-Pyrrole-2-carboxylic acid, 3,4-dimethyl-5-[(1,3,3-trimethyl-5-oxo-2-pyrrolidinylidene)methyl]-, 1,1-dimethylethyl ester, (E)-

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1H-Pyrrole-2-carboxylic acid, 3,4-dimethyl-5-[(1,3,3-trimethyl-5-oxo-2-pyrrolidinylidene)methyl]-, 1,1-dimethylethyl ester, (E)-
SpectraBase Compound ID FeVb2bKMvSR
InChI InChI=1S/C19H28N2O3/c1-11-12(2)16(17(23)24-18(3,4)5)20-13(11)9-14-19(6,7)10-15(22)21(14)8/h9,20H,10H2,1-8H3/b14-9+
InChIKey LRJKQVSYDPKGJL-NTEUORMPSA-N
Mol Weight 332.44 g/mol
Molecular Formula C19H28N2O3
Exact Mass 332.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ul9umaYZA3
Name 1H-Pyrrole-2-carboxylic acid, 3,4-dimethyl-5-[(1,3,3-trimethyl-5-oxo-2-pyrrolidinylidene)methyl]-, 1,1-dimethylethyl ester, (E)-
CAS Registry Number 87233-06-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28N2O3
InChI InChI=1S/C19H28N2O3/c1-11-12(2)16(17(23)24-18(3,4)5)20-13(11)9-14-19(6,7)10-15(22)21(14)8/h9,20H,10H2,1-8H3/b14-9+
InChIKey LRJKQVSYDPKGJL-NTEUORMPSA-N
Molecular Weight 332.444 g/mol
SMILES [nH]1c(c(c(c1C(OC(C)(C)C)=O)C)C)\C=C/1N(C(=O)CC1(C)C)C
SPLASH splash10-05rr-2092000000-cfdfb97e9238e7aa85a5
Source of Spectrum AH-114-765-0
Synonyms tert-Butyl ester of (Z)-1,3,3,3',4'-pentamethyl-1,3,4,5-tetrahydro-5-oxo-2,2'-pyrromethen-5'-carboxlic acid tert-Butyl 3,4-dimethyl-5-[(E)-(1,3,3-trimethyl-5-oxo-2-pyrrolidinylidene)methyl]-1H-pyrrole-2-carboxylate tert-Butyl ester of (E)-1,3,3,3',4'-pentamethyl-1,3,4,5-tetrahydro-5-oxo-2,2'-pyrromethen-5'-carboxylic acid
Wiley ID 1329503