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Ethyl 4-(2-chlorobenzoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
SpectraBase Compound ID GpAl81WcHCQ
InChI InChI=1S/C16H16ClNO3/c1-4-21-16(20)14-9(2)13(10(3)18-14)15(19)11-7-5-6-8-12(11)17/h5-8,18H,4H2,1-3H3
InChIKey IJNDRMGKGFHDHH-UHFFFAOYSA-N
Mol Weight 305.76 g/mol
Molecular Formula C16H16ClNO3
Exact Mass 305.081871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7dvqnZMILlV
Name Ethyl 4-(2-chlorobenzoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate
CAS Registry Number 298687-87-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16ClNO3
InChI InChI=1S/C16H16ClNO3/c1-4-21-16(20)14-9(2)13(10(3)18-14)15(19)11-7-5-6-8-12(11)17/h5-8,18H,4H2,1-3H3
InChIKey IJNDRMGKGFHDHH-UHFFFAOYSA-N
Molecular Weight 305.761 g/mol
SMILES [nH]1c(c(c(c1C)C(c1c(Cl)cccc1)=O)C)C(=O)OCC
SPLASH splash10-05fr-4793000000-d435a7db92d821e72919
Source of Spectrum AD-0-2532-0
Synonyms 4-(2-Chlorobenzoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester 4-[(2-chlorophenyl)-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-(2-chlorophenyl)carbonyl-3,5-dimethyl-1H-pyrrole-2-carboxylate Pyrrole-2-carboxylic acid, 4-(2-chlorobenzoyl)-3,5-dimethyl-, ethyl ester
Wiley ID 1430009