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1-[[(2,2-DIFLUORO-3,3-DIMETHYLCYCLOPROPYLIDENE)-(TOLYL)-METHYL]-SULFONYL]-4-METHYLBENZENE
SpectraBase Compound ID KRjXBX1Weis
InChI InChI=1S/C20H20F2O2S/c1-13-5-9-15(10-6-13)17(18-19(3,4)20(18,21)22)25(23,24)16-11-7-14(2)8-12-16/h5-12H,1-4H3/b18-17+
InChIKey IVCBOESBXKEOAX-ISLYRVAYSA-N
Mol Weight 362.43 g/mol
Molecular Formula C20H20F2O2S
Exact Mass 362.115207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxRZpgat72L
Name 1-[(E)-(2,2-difluoro-3,3-dimethyl-cyclopropylidene)-(p-tolylsulfonyl)methyl]-4-methyl-benzene
Alternate Name(s) 1-[(E)-(2,2-difluoro-3,3-dimethyl-cyclopropylidene)-tosyl-methyl]-4-methyl-benzene 1-[(E)-(2,2-difluoro-3,3-dimethylcyclopropylidene)-(4-methylphenyl)sulfonylmethyl]-4-methylbenzene 1-[(E)-[2,2-bis(fluoranyl)-3,3-dimethyl-cyclopropylidene]-(4-methylphenyl)sulfonyl-methyl]-4-methyl-benzene
Comments Less than 3 mono-isotopic peaks
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Formula C20H20F2O2S
InChI InChI=1S/C20H20F2O2S/c1-13-5-9-15(10-6-13)17(18-19(3,4)20(18,21)22)25(23,24)16-11-7-14(2)8-12-16/h5-12H,1-4H3/b18-17+
InChIKey IVCBOESBXKEOAX-ISLYRVAYSA-N
Molecular Weight 362.435 g/mol
SMILES C1(\C(C1(C)C)=C/(S(c1ccc(cc1)C)(=O)=O)c1ccc(cc1)C)(F)F
SPLASH splash10-014i-0900000000-34195ff145e1cdf96be0
Source of Spectrum K1-0-5585-4
Wiley ID 1589839