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1H-Pyrrole-3-carboxylic acid, 4-(acetylamino)-1-butyl-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, methyl ester
SpectraBase Compound ID 6fa8ThY79sy
InChI InChI=1S/C14H19F3N2O4/c1-5-6-7-19-8(2)10(11(21)23-4)13(12(19)22,14(15,16)17)18-9(3)20/h5-7H2,1-4H3,(H,18,20)
InChIKey FJDTWYYPPYPQQN-UHFFFAOYSA-N
Mol Weight 336.31 g/mol
Molecular Formula C14H19F3N2O4
Exact Mass 336.129692 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PkEndT0TD2
Name 1H-Pyrrole-3-carboxylic acid, 4-(acetylamino)-1-butyl-4,5-dihydro-2-methyl-5-oxo-4-(trifluoromethyl)-, methyl ester
Alternate Name(s) 4-Acetamido-1-butyl-2-methyl-5-oxo-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester Methyl 4-acetamido-1-butyl-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Methyl 4-acetamido-1-butyl-2-methyl-5-oxidanylidene-4-(trifluoromethyl)pyrrole-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19F3N2O4
InChI InChI=1S/C14H19F3N2O4/c1-5-6-7-19-8(2)10(11(21)23-4)13(12(19)22,14(15,16)17)18-9(3)20/h5-7H2,1-4H3,(H,18,20)
InChIKey FJDTWYYPPYPQQN-UHFFFAOYSA-N
Molecular Weight 336.311 g/mol
SMILES N(C1(C(N(C(=C1C(=O)OC)C)CCCC)=O)C(F)(F)F)C(=O)C
SPLASH splash10-002o-3493000000-0084bc2692d3964ce263
Source of Spectrum IY-2-4804-9
Wiley ID 1656032