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3-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-methyl-4-quinazolinone
SpectraBase Compound ID HhZ0KIstCQs
InChI InChI=1S/C16H10F2N2O3/c1-9-19-12-5-3-2-4-11(12)15(21)20(9)10-6-7-13-14(8-10)23-16(17,18)22-13/h2-8H,1H3
InChIKey PGKLVWFLUMSDQG-UHFFFAOYSA-N
Mol Weight 316.26 g/mol
Molecular Formula C16H10F2N2O3
Exact Mass 316.065949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMyJUNlPTT8
Name 3-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-methyl-4-quinazolinone
Alternate Name(s) 3-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-methyl-quinazolin-4-one 3-[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]-2-methyl-quinazolin-4-one
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Formula C16H10F2N2O3
InChI InChI=1S/C16H10F2N2O3/c1-9-19-12-5-3-2-4-11(12)15(21)20(9)10-6-7-13-14(8-10)23-16(17,18)22-13/h2-8H,1H3
InChIKey PGKLVWFLUMSDQG-UHFFFAOYSA-N
Molecular Weight 316.264 g/mol
SMILES c1cc2N=C(N(C(c2cc1)=O)c1cc2OC(F)(F)Oc2cc1)C
SPLASH splash10-014l-9605000000-8e118c833df7bdbffbf0
Wiley ID 1451621