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

View entire compound with spectra: 1 MS (GC)

1H-Pyrrole-3-carboxylic acid, 4-(acetylamino)-4,5-dihydro-2-methyl-1-(1-methylethyl)-5-oxo-4-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID 7KxujSBVlkM
InChI InChI=1S/C13H17F3N2O4/c1-6(2)18-7(3)9(10(20)22-5)12(11(18)21,13(14,15)16)17-8(4)19/h6H,1-5H3,(H,17,19)
InChIKey AXJNHSGLBWSTRA-UHFFFAOYSA-N
Mol Weight 322.28 g/mol
Molecular Formula C13H17F3N2O4
Exact Mass 322.114042 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gv4pCp03v8F
Name 1H-Pyrrole-3-carboxylic acid, 4-(acetylamino)-4,5-dihydro-2-methyl-1-(1-methylethyl)-5-oxo-4-(trifluoromethyl)-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17F3N2O4
InChI InChI=1S/C13H17F3N2O4/c1-6(2)18-7(3)9(10(20)22-5)12(11(18)21,13(14,15)16)17-8(4)19/h6H,1-5H3,(H,17,19)
InChIKey AXJNHSGLBWSTRA-UHFFFAOYSA-N
Molecular Weight 322.284 g/mol
SMILES N(C1(C(N(C(=C1C(=O)OC)C)C(C)C)=O)C(F)(F)F)C(=O)C
SPLASH splash10-01vo-5593000000-d790ed8162d9fcb63c7c
Source of Spectrum IY-2-4804-8
Synonyms 4-Acetamido-2-methyl-5-oxo-1-propan-2-yl-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester Methyl 4-acetamido-2-methyl-5-oxo-1-propan-2-yl-4-(trifluoromethyl)pyrrole-3-carboxylate Methyl 4-acetamido-1-isopropyl-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Methyl 4-acetamido-2-methyl-5-oxidanylidene-1-propan-2-yl-4-(trifluoromethyl)pyrrole-3-carboxylate
Wiley ID 1656031