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3-(trifluoromethyl)-1,4-dihydropyrazol-5-one
SpectraBase Compound ID 14UgULV8OA0
InChI InChI=1S/C4H3F3N2O/c5-4(6,7)2-1-3(10)9-8-2/h1H2,(H,9,10)
InChIKey PMTWALQJNWEDLH-UHFFFAOYSA-N
Mol Weight 152.08 g/mol
Molecular Formula C4H3F3N2O
Exact Mass 152.019747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Qvtc2s18S
Name 3-(trifluoromethyl)-1,4-dihydropyrazol-5-one
Alternate Name(s) 5-(trifluoromethyl)-2-pyrazolin-3-one Pyrazol-3-one, 5-trifluoromethyl-2,4-dihydro-
CAS Registry Number 401-73-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H3F3N2O
InChI InChI=1S/C4H3F3N2O/c5-4(6,7)2-1-3(10)9-8-2/h1H2,(H,9,10)
InChIKey PMTWALQJNWEDLH-UHFFFAOYSA-N
Molecular Weight 152.076 g/mol
SMILES N1C(CC(=N1)C(F)(F)F)=O
SPLASH splash10-0fb9-9300000000-cbe60683c5b143c891f5
Wiley ID 1441109