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Pyrrole-2-carboxylic acid, 4-(2-bromobenzoyl)-3,5-dimethyl-, ethyl ester
SpectraBase Compound ID 2PbGfz8AuGU
InChI InChI=1S/C16H16BrNO3/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 ULTMQTAMZRQSLO-UHFFFAOYSA-N
Mol Weight 350.21 g/mol
Molecular Formula C16H16BrNO3
Exact Mass 349.031356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2LJigDc30FH
Name Pyrrole-2-carboxylic acid, 4-(2-bromobenzoyl)-3,5-dimethyl-, ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16BrNO3
InChI InChI=1S/C16H16BrNO3/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 ULTMQTAMZRQSLO-UHFFFAOYSA-N
Molecular Weight 350.212 g/mol
SMILES [nH]1c(c(c(c1C)C(c1c(Br)cccc1)=O)C)C(=O)OCC
SPLASH splash10-00dj-4894000000-2340c0f320d92fba56ae
Source of Spectrum AD-0-2532-0
Synonyms 4-(2-bromobenzoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester 4-[(2-bromophenyl)-oxomethyl]-3,5-dimethyl-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 4-(2-bromobenzoyl)-3,5-dimethyl-1H-pyrrole-2-carboxylate Ethyl 4-(2-bromophenyl)carbonyl-3,5-dimethyl-1H-pyrrole-2-carboxylate
Wiley ID 1430022