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2,4(1H,3H)-Pyrimidinedione, 6-(trifluoromethyl)-
SpectraBase Compound ID IVU5ZV4ldgq
InChI InChI=1S/C5H3F3N2O2/c6-5(7,8)2-1-3(11)10-4(12)9-2/h1H,(H2,9,10,11,12)
InChIKey IROWWTVZNHKLLE-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 HrIosCnXSbx
Name 2,4(1H,3H)-Pyrimidinedione, 6-(trifluoromethyl)-
CAS Registry Number 672-45-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H3F3N2O2
InChI InChI=1S/C5H3F3N2O2/c6-5(7,8)2-1-3(11)10-4(12)9-2/h1H,(H2,9,10,11,12)
InChIKey IROWWTVZNHKLLE-UHFFFAOYSA-N
Molecular Weight 180.086 g/mol
SMILES Oc1nc(nc(c1)C(F)(F)F)O
SPLASH splash10-0159-9700000000-55575045d622c27c1a84
Source of Spectrum J-55-1398-1
Synonyms 6-(Trifluoromethyl)-2,4-pyrimidinediol 6-(trifluoromethyl)-1H-pyrimidine-2,4-dione 6-(Trifluoromethyl)uracil Uracil, 6-(trifluoromethyl)-
Wiley ID 1175561