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1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 MS (GC)

1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
SpectraBase Compound ID G6efbDpqDJY
InChI InChI=1S/C6H5F3N2O2/c1-11-3(5(12)13)2-4(10-11)6(7,8)9/h2H,1H3,(H,12,13)
InChIKey AQUQLOWJSBFHBD-UHFFFAOYSA-N
Mol Weight 194.11 g/mol
Molecular Formula C6H5F3N2O2
Exact Mass 194.030312 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4YRsFGVj3oT
Name 1-Methyl-3-trifluoromethyl-pyrazole-5-carboxylic acid
CAS Registry Number 128694-63-3
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H5F3N2O2
InChI InChI=1S/C6H5F3N2O2/c1-11-3(5(12)13)2-4(10-11)6(7,8)9/h2H,1H3,(H,12,13)
InChIKey AQUQLOWJSBFHBD-UHFFFAOYSA-N
Instrument Name Bruker IFS 85 B
Purity slightly contaminated
Synonyms 1H-Pyrazole-5-carboxylic acid, 1-methyl-3-(trifluoromethyl)-
Technique KBr-Pellet