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2-[4-methyl-6-(trichloromethyl)pyrimidin-2-yl]-3-(trichloromethyl)-4H-pyrazol-3-ol
SpectraBase Compound ID 8Jwnnb9z2yz
InChI InChI=1S/C10H8Cl6N4O/c1-5-4-6(9(11,12)13)19-7(18-5)20-8(21,2-3-17-20)10(14,15)16/h3-4,21H,2H2,1H3
InChIKey JXRKWEOBCUSRKP-UHFFFAOYSA-N
Mol Weight 412.9 g/mol
Molecular Formula C10H8Cl6N4O
Exact Mass 409.882927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FDVU8YImEaP
Name 2-[4-methyl-6-(trichloromethyl)-2-pyrimidinyl]-3-(trichloromethyl)-4H-pyrazol-3-ol
Alternate Name(s) 2-[4-methyl-6-(trichloromethyl)pyrimidin-2-yl]-3-(trichloromethyl)-2-pyrazolin-3-ol 2-[4-methyl-6-(trichloromethyl)pyrimidin-2-yl]-3-(trichloromethyl)-4H-pyrazol-3-ol
Comments Less than 3 mono-isotopic peaks
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Formula C10H8Cl6N4O
InChI InChI=1S/C10H8Cl6N4O/c1-5-4-6(9(11,12)13)19-7(18-5)20-8(21,2-3-17-20)10(14,15)16/h3-4,21H,2H2,1H3
InChIKey JXRKWEOBCUSRKP-UHFFFAOYSA-N
Molecular Weight 412.919 g/mol
SMILES OC1(N(c2nc(cc(n2)C(Cl)(Cl)Cl)C)N=CC1)C(Cl)(Cl)Cl
SPLASH splash10-000i-0090000000-a640168f7c117962a957
Source of Spectrum C5-2003-897-11
Wiley ID 1615560