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4,4-DICHLORO-5-(TRIFLUOROMETHYL)-5-PYRAZOLIN-3-ONE
SpectraBase Compound ID 3cS4GH4Am8q
InChI InChI=1S/C4HCl2F3N2O/c5-3(6)1(4(7,8)9)10-11-2(3)12/h(H,11,12)
InChIKey BPPNRGPLYZIDHX-UHFFFAOYSA-N
Mol Weight 220.97 g/mol
Molecular Formula C4HCl2F3N2O
Exact Mass 219.941803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I52HJmovsad
Name 4,4-bis(chloranyl)-3-(trifluoromethyl)-1H-pyrazol-5-one
CAS Registry Number 76481-00-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4HCl2F3N2O
InChI InChI=1S/C4HCl2F3N2O/c5-3(6)1(4(7,8)9)10-11-2(3)12/h(H,11,12)
InChIKey BPPNRGPLYZIDHX-UHFFFAOYSA-N
Molecular Weight 220.966 g/mol
SMILES N1N=C(C(C1=O)(Cl)Cl)C(F)(F)F
SPLASH splash10-000x-8910000000-c5b0ab6308ea3c189ec8
Source of Spectrum J-46-1537-0
Synonyms 4,4-Dichloro-3-(trifluoromethyl)-1H-pyrazol-5-one 4,4-Dichloro-5-(trifluoromethyl)-2-pyrazolin-3-one
Wiley ID 1219161