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3,5-Dimethyl-4-nitropyrrole-2-carboxylic acid, ethyl ester
SpectraBase Compound ID BzkTgwCbu9c
InChI InChI=1S/C9H12N2O4/c1-4-15-9(12)7-5(2)8(11(13)14)6(3)10-7/h10H,4H2,1-3H3
InChIKey AZGXAAUDJWAVHF-UHFFFAOYSA-N
Mol Weight 212.2 g/mol
Molecular Formula C9H12N2O4
Exact Mass 212.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 64g1OF3jIFx
Name Ethyl 3,5-dimethyl-4-nitro-1H-pyrrole-2-carboxylate
CAS Registry Number 5463-44-5
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N2O4
InChI InChI=1S/C9H12N2O4/c1-4-15-9(12)7-5(2)8(11(13)14)6(3)10-7/h10H,4H2,1-3H3
InChIKey AZGXAAUDJWAVHF-UHFFFAOYSA-N
Molecular Weight 212.205 g/mol
SMILES CCOC(=O)c1c(C)c(N(=O)=O)c([nH]1)C
SPLASH splash10-00kb-9710000000-ebcb36215bc9f67df94b
Source of Spectrum HE-1986-910-0
Synonyms 1H-Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester 3,5-Dimethyl-4-nitro-1H-pyrrole-2-carboxylic acid ethyl ester Pyrrole-2-carboxylic acid, 3,5-dimethyl-4-nitro-, ethyl ester
Wiley ID 1210884