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1H-Pyrazole-5-carboxylic acid, 3-(trifluoromethyl)-
SpectraBase Compound ID F7UzOV2gUlo
InChI InChI=1S/C5H3F3N2O2/c6-5(7,8)3-1-2(4(11)12)9-10-3/h1H,(H,9,10)(H,11,12)
InChIKey CIVNBJPTGRMGRS-UHFFFAOYSA-N
Mol Weight 180.09 g/mol
Molecular Formula C5H3F3N2O2
Exact Mass 180.014662 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9TQhOdvC2Wj
Name 1H-Pyrazole-5-carboxylic acid, 3-(trifluoromethyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H3F3N2O2
InChI InChI=1S/C5H3F3N2O2/c6-5(7,8)3-1-2(4(11)12)9-10-3/h1H,(H,9,10)(H,11,12)
InChIKey CIVNBJPTGRMGRS-UHFFFAOYSA-N
Molecular Weight 180.086 g/mol
SMILES OC(c1cc(n[nH]1)C(F)(F)F)=O
SPLASH splash10-067r-9600000000-9ba7f3699f81925f5561
Source of Spectrum IY-2-4848-2
Synonyms 3-(trifluoromethyl)-1H-pyrazole-5-carboxylic acid
Wiley ID 1656705