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1,1-Difluoro-2-[(tolyl-4-sulfonyl)methylidene]spiro[2.5]octane
SpectraBase Compound ID KfVP9Fyl1Jw
InChI InChI=1S/C16H18F2O2S/c1-12-5-7-13(8-6-12)21(19,20)11-14-15(16(14,17)18)9-3-2-4-10-15/h5-8,11H,2-4,9-10H2,1H3/b14-11+
InChIKey WKFQQOJSBUYXJI-SDNWHVSQSA-N
Mol Weight 312.37 g/mol
Molecular Formula C16H18F2O2S
Exact Mass 312.099557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JnmYfuZWiMW
Name 1,1-Difluoro-2-[(tolyl-4-sulfonyl)methylidene]spiro[2.5]octane
Comments Less than 3 mono-isotopic peaks
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Formula C16H18F2O2S
InChI InChI=1S/C16H18F2O2S/c1-12-5-7-13(8-6-12)21(19,20)11-14-15(16(14,17)18)9-3-2-4-10-15/h5-8,11H,2-4,9-10H2,1H3/b14-11+
InChIKey WKFQQOJSBUYXJI-SDNWHVSQSA-N
Molecular Weight 312.375 g/mol
SMILES C1(\C(C11CCCCC1)=C\S(c1ccc(cc1)C)(=O)=O)(F)F
SPLASH splash10-0006-9001000000-5de8eb67bd2c8746d266
Source of Spectrum K1-0-5585-2
Synonyms (1E)-2,2-difluoro-1-[(4-methylphenyl)sulfonylmethylidene]spiro[2.5]octane (1E)-2,2-difluoro-1-(p-tolylsulfonylmethylene)spiro[2.5]octane (1E)-2,2-bis(fluoranyl)-1-[(4-methylphenyl)sulfonylmethylidene]spiro[2.5]octane
Wiley ID 1589844