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4-[(E)-2-(4-tert-butylphenyl)ethenyl]-6-(trifluoromethyl)-2(1H)-pyrimidinone
SpectraBase Compound ID HkD6W5iMI3N
InChI InChI=1S/C17H17F3N2O/c1-16(2,3)12-7-4-11(5-8-12)6-9-13-10-14(17(18,19)20)22-15(23)21-13/h4-10H,1-3H3,(H,21,22,23)/b9-6+
InChIKey KUKSIYZPNBFGHM-RMKNXTFCSA-N
Mol Weight 322.33 g/mol
Molecular Formula C17H17F3N2O
Exact Mass 322.129298 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EvvVMh8xMcp
Name 4-[2-(4-tert-butyl-phenyl)-vinyl]-6-trifluoromethyl-1H-pyrimidin-2-one
Alternate Name(s) 4-[(E)-2-(4-tert-butylphenyl)ethenyl]-6-(trifluoromethyl)-2(1H)-pyrimidinone 4-[2-(4-tert-butylphenyl)ethenyl]-6-(trifluoromethyl)-2(1H)-pyrimidinone 4-[(E)-2-(4-tert-butylphenyl)ethenyl]-6-(trifluoromethyl)-1H-pyrimidin-2-one
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Formula C17H17F3N2O
InChI InChI=1S/C17H17F3N2O/c1-16(2,3)12-7-4-11(5-8-12)6-9-13-10-14(17(18,19)20)22-15(23)21-13/h4-10H,1-3H3,(H,21,22,23)/b9-6+
InChIKey KUKSIYZPNBFGHM-RMKNXTFCSA-N
Molecular Weight 322.331 g/mol
SMILES N1C(=CC(=NC1=O)\C=C\c1ccc(C(C)(C)C)cc1)C(F)(F)F
SPLASH splash10-0abc-9614000000-539ec70ba28da23db800
Wiley ID 1451813