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(NZ)-N-[2-[4-(difluoromethyl)-6-phenylpyrimidin-2-yl]sulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-ylidene]hydroxylamine
SpectraBase Compound ID 1MBn0SHbYqt
InChI InChI=1S/C17H15F2N3O3S/c18-15(19)11-6-10(9-4-2-1-3-5-9)20-17(21-11)26-14-7-12(22-23)16-24-8-13(14)25-16/h1-6,13-16,23H,7-8H2/b22-12-/t13-,14?,16-/m1/s1
InChIKey ARSOMLNPDAIQKS-VUPCJNLSSA-N
Mol Weight 379.38 g/mol
Molecular Formula C17H15F2N3O3S
Exact Mass 379.080219 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QWAq5pnmT3
Name (NZ)-N-[2-[4-(difluoromethyl)-6-phenylpyrimidin-2-yl]sulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-ylidene]hydroxylamine
Alternate Name(s) (NZ)-N-[2-[4-[bis(fluoranyl)methyl]-6-phenyl-pyrimidin-2-yl]sulfanyl-6,8-dioxabicyclo[3.2.1]octan-4-ylidene]hydroxylamine 2-[[4-(difluoromethyl)-6-phenyl-2-pyrimidinyl]thio]-6,8-dioxabicyclo[3.2.1]octan-4-one oxime 2-[[4-(difluoromethyl)-6-phenyl-pyrimidin-2-yl]thio]-6,8-dioxabicyclo[3.2.1]octan-4-one oxime
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Formula C17H15F2N3O3S
InChI InChI=1S/C17H15F2N3O3S/c18-15(19)11-6-10(9-4-2-1-3-5-9)20-17(21-11)26-14-7-12(22-23)16-24-8-13(14)25-16/h1-6,13-16,23H,7-8H2/b22-12-/t13-,14?,16-/m1/s1
InChIKey ARSOMLNPDAIQKS-VUPCJNLSSA-N
Molecular Weight 379.382 g/mol
SMILES O\N=C\1CC([C@@]2(O[C@]1(OC2)[H])[H])Sc1nc(C(F)F)cc(n1)-c1ccccc1
SPLASH splash10-000i-9431000000-d49fc5ec8c15d160f4e7
Wiley ID 1453255