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Ethyl 3,5-dimethyl-4-(trifluoroacetyl)-1H-pyrrole-2-carboxylate
SpectraBase Compound ID HYExu5ZV7mc
InChI InChI=1S/C11H12F3NO3/c1-4-18-10(17)8-5(2)7(6(3)15-8)9(16)11(12,13)14/h15H,4H2,1-3H3
InChIKey HKYOMTBDTQUFSR-UHFFFAOYSA-N
Mol Weight 263.22 g/mol
Molecular Formula C11H12F3NO3
Exact Mass 263.076928 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I4K5BbHwfX5
Name Ethyl 3,5-dimethyl-4-(trifluoroacetyl)-1H-pyrrole-2-carboxylate
Alternate Name(s) 3,5-Dimethyl-4-(2,2,2-trifluoro-1-oxoethyl)-1H-pyrrole-2-carboxylic acid ethyl ester 3,5-Dimethyl-4-(2,2,2-trifluoroacetyl)-1H-pyrrole-2-carboxylic acid ethyl ester Ethyl 3,5-dimethyl-4-(2,2,2-trifluoroacetyl)-1H-pyrrole-2-carboxylate Ethyl 3,5-dimethyl-4-[2,2,2-tris(fluoranyl)ethanoyl]-1H-pyrrole-2-carboxylate Pyrrole-2-carboxylic acid, 4-trifluoroacetyl-3,5-dimethyl-, ethyl ester
CAS Registry Number 177340-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12F3NO3
InChI InChI=1S/C11H12F3NO3/c1-4-18-10(17)8-5(2)7(6(3)15-8)9(16)11(12,13)14/h15H,4H2,1-3H3
InChIKey HKYOMTBDTQUFSR-UHFFFAOYSA-N
Molecular Weight 263.216 g/mol
SMILES [nH]1c(c(c(c1C)C(C(F)(F)F)=O)C)C(=O)OCC
SPLASH splash10-0002-4910000000-a03818426d54cc697a96
Wiley ID 1456562