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1-{[(2-t-Butyl-3,3-difluoro-2-methylcyclopropylidene)methyl]sulfonyl}-4-methylbenzene
SpectraBase Compound ID 4EsZ7oEeXUv
InChI InChI=1S/C16H20F2O2S/c1-11-6-8-12(9-7-11)21(19,20)10-13-15(5,14(2,3)4)16(13,17)18/h6-10H,1-5H3/b13-10-
InChIKey CDOGUKIARGGOID-RAXLEYEMSA-N
Mol Weight 314.39 g/mol
Molecular Formula C16H20F2O2S
Exact Mass 314.115207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BqtPwVYHdIq
Name 1-{[(2-t-Butyl-3,3-difluoro-2-methylcyclopropylidene)methyl]sulfonyl}-4-methylbenzene
Alternate Name(s) (Z)-(2-tert-butyl-3,3-difluoro-2-methylcyclopropylidene)methyl 4-methylphenyl sulfone 1-{[(Z)-(2-tert-butyl-3,3-difluoro-2-methylcyclopropylidene)methyl]sulfonyl}-4-methylbenzene
Comments Less than 3 mono-isotopic peaks
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Formula C16H20F2O2S
InChI InChI=1S/C16H20F2O2S/c1-11-6-8-12(9-7-11)21(19,20)10-13-15(5,14(2,3)4)16(13,17)18/h6-10H,1-5H3/b13-10-
InChIKey CDOGUKIARGGOID-RAXLEYEMSA-N
Molecular Weight 314.391 g/mol
SMILES c1(ccc(cc1)C)S(=O)(=O)\C=C\1C(C1(F)F)(C)C(C)(C)C
SPLASH splash10-000i-0902000000-b44d6f6735bb3f50d171
Source of Spectrum K1-0-5585-2
Wiley ID 1589842