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5-Amino-1-(4-trifluoromethoxy-phenyl)-1H-pyrazole-4-carboxylic acid ethyl ester
SpectraBase Compound ID KyKtcLD1fZ6
InChI InChI=1S/C13H12F3N3O3/c1-2-21-12(20)10-7-18-19(11(10)17)8-3-5-9(6-4-8)22-13(14,15)16/h3-7H,2,17H2,1H3
InChIKey ZUAXHCNKPJHCEU-UHFFFAOYSA-N
Mol Weight 315.25 g/mol
Molecular Formula C13H12F3N3O3
Exact Mass 315.083076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Q1iIM9aJNW
Name 5-Amino-1-(4-trifluoromethoxy-phenyl)-1H-pyrazole-4-carboxylic acid ethyl ester
Alternate Name(s) 5-Amino-1-[4-(trifluoromethoxy)phenyl]-4-pyrazolecarboxylic acid ethyl ester 5-Amino-1-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxylic acid ethyl ester Ethyl 5-amino-1-[4-(trifluoromethoxy)phenyl]-1H-pyrazole-4-carboxylate Ethyl 5-amino-1-[4-(trifluoromethoxy)phenyl]pyrazole-4-carboxylate Ethyl 5-azanyl-1-[4-(trifluoromethyloxy)phenyl]pyrazole-4-carboxylate
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Formula C13H12F3N3O3
InChI InChI=1S/C13H12F3N3O3/c1-2-21-12(20)10-7-18-19(11(10)17)8-3-5-9(6-4-8)22-13(14,15)16/h3-7H,2,17H2,1H3
InChIKey ZUAXHCNKPJHCEU-UHFFFAOYSA-N
Molecular Weight 315.252 g/mol
SMILES Nc1c(cn[n]1-c1ccc(OC(F)(F)F)cc1)C(=O)OCC
SPLASH splash10-014i-2393000000-663b8b4a1e82aae28214
Wiley ID 1461550