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1-Carboxymethyl-5-trifluoromethyl-5-hydroxy-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazole
SpectraBase Compound ID ArTHfMczmYT
InChI InChI=1S/C12H10F3N3O5/c1-23-10(19)17-11(20,12(13,14)15)6-9(16-17)7-2-4-8(5-3-7)18(21)22/h2-5,20H,6H2,1H3
InChIKey ZTNKOOYNASNJIN-UHFFFAOYSA-N
Mol Weight 333.22 g/mol
Molecular Formula C12H10F3N3O5
Exact Mass 333.057255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 25OajWPjf5z
Name 1-Carboxymethyl-5-trifluoromethyl-5-hydroxy-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10F3N3O5
InChI InChI=1S/C12H10F3N3O5/c1-23-10(19)17-11(20,12(13,14)15)6-9(16-17)7-2-4-8(5-3-7)18(21)22/h2-5,20H,6H2,1H3
InChIKey ZTNKOOYNASNJIN-UHFFFAOYSA-N
Molecular Weight 333.223 g/mol
SMILES OC1(N(N=C(c2ccc(N(=O)=O)cc2)C1)C(=O)OC)C(F)(F)F
SPLASH splash10-03di-0093000000-e1fa148e1fedffdd2fe7
Source of Spectrum Y-47-307-3i
Synonyms 5-Hydroxy-3-(4-nitro-phenyl)-5-trifluoromethyl-4,5-dihydro-pyrazole-1-carboxylic acid methyl ester 5-Hydroxy-3-(4-nitrophenyl)-5-(trifluoromethyl)-4H-pyrazole-1-carboxylic acid methyl ester Methyl 5-hydroxy-3-(4-nitrophenyl)-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate Methyl 3-(4-nitrophenyl)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazole-1-carboxylate
Wiley ID 1667086