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1H-Pyrrole-3-carboxylic acid, 4-(acetylamino)-4,5-dihydro-2-methyl-5-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-, methyl ester

View entire compound with spectra: 1 MS (GC)

1H-Pyrrole-3-carboxylic acid, 4-(acetylamino)-4,5-dihydro-2-methyl-5-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID 4OQcH0kr4Lq
InChI InChI=1S/C17H17F3N2O4/c1-10-13(14(24)26-3)16(17(18,19)20,21-11(2)23)15(25)22(10)9-12-7-5-4-6-8-12/h4-8H,9H2,1-3H3,(H,21,23)
InChIKey OGIKKKPSBJAVPE-UHFFFAOYSA-N
Mol Weight 370.33 g/mol
Molecular Formula C17H17F3N2O4
Exact Mass 370.114042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMZiGAAKQNT
Name 1H-Pyrrole-3-carboxylic acid, 4-(acetylamino)-4,5-dihydro-2-methyl-5-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17F3N2O4
InChI InChI=1S/C17H17F3N2O4/c1-10-13(14(24)26-3)16(17(18,19)20,21-11(2)23)15(25)22(10)9-12-7-5-4-6-8-12/h4-8H,9H2,1-3H3,(H,21,23)
InChIKey OGIKKKPSBJAVPE-UHFFFAOYSA-N
Molecular Weight 370.328 g/mol
SMILES N(C1(C(N(C(=C1C(=O)OC)C)Cc1ccccc1)=O)C(F)(F)F)C(=O)C
SPLASH splash10-0006-9121000000-0a5859e3968a9dd76bbd
Source of Spectrum IY-2-5023-8
Synonyms Methyl 1-benzyl-4-acetamido-2-methyl-5-oxo-4-(trifluoromethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate 4-Acetamido-2-methyl-5-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester Methyl 4-acetamido-1-benzyl-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Methyl 4-acetamido-2-methyl-5-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyrrole-3-carboxylate
Wiley ID 1658221