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3-(4-Methylphenyl)sulfonylbicyclo[2.2.1]hepta-2,5-diene
SpectraBase Compound ID BGcBAfaS7FK
InChI InChI=1S/C14H14O2S/c1-10-2-6-13(7-3-10)17(15,16)14-9-11-4-5-12(14)8-11/h2-7,9,11-12H,8H2,1H3/t11-,12+/m0/s1
InChIKey WKBPVXBUOZBTNQ-NWDGAFQWSA-N
Mol Weight 246.32 g/mol
Molecular Formula C14H14O2S
Exact Mass 246.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EUVZ9XuUHv7
Name 3-(4-Methylphenyl)sulfonylbicyclo[2.2.1]hepta-2,5-diene
Alternate Name(s) 3-(p-tolylsulfonyl)bicyclo[2.2.1]hepta-2,5-diene 3-Tosylbicyclo[2.2.1]hepta-2,5-diene
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Formula C14H14O2S
InChI InChI=1S/C14H14O2S/c1-10-2-6-13(7-3-10)17(15,16)14-9-11-4-5-12(14)8-11/h2-7,9,11-12H,8H2,1H3/t11-,12+/m0/s1
InChIKey WKBPVXBUOZBTNQ-NWDGAFQWSA-N
Molecular Weight 246.324 g/mol
SMILES C=1(S(c2ccc(cc2)C)(=O)=O)[C@@]2(C=C[C@](C1)(C2)[H])[H]
SPLASH splash10-0006-9110000000-3efb22fe190754bb1944
Source of Spectrum KC-0-2735-1
Wiley ID 831450