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2H-Pyrrole-3-carboxylic acid, 2,2-dimethyl-5-(methylphenylamino)-, ethyl ester
SpectraBase Compound ID 4IhUPe9sg5A
InChI InChI=1S/C16H20N2O2/c1-5-20-15(19)13-11-14(17-16(13,2)3)18(4)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3
InChIKey QRKXXAHHAGVATK-UHFFFAOYSA-N
Mol Weight 272.35 g/mol
Molecular Formula C16H20N2O2
Exact Mass 272.152478 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2U3xtmtaLU0
Name 2H-Pyrrole-3-carboxylic acid, 2,2-dimethyl-5-(methylphenylamino)-, ethyl ester
CAS Registry Number 85937-68-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O2
InChI InChI=1S/C16H20N2O2/c1-5-20-15(19)13-11-14(17-16(13,2)3)18(4)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3
InChIKey QRKXXAHHAGVATK-UHFFFAOYSA-N
Molecular Weight 272.348 g/mol
SMILES C1(=CC(N(c2ccccc2)C)=NC1(C)C)C(=O)OCC
SPLASH splash10-0a4i-6950000000-0fa31af81e9e711945c6
Source of Spectrum H-66-289-0
Synonyms Ethyl 2,2-dimethyl-5-(methylanilino)-2H-pyrrole-3-carboxylate Ethyl ester of 2,2-dimethyl-5-(N-methylanilino)-2H-pyrrol-3-carboxylic acid Ethyl ester of 4,4-dimethyl-7-phenyl-5,7-diazaoct-5-en-2-inoic acid
Wiley ID 1276327