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(E)-1-(Benzenesulfonyl)-2-phenyloct-1-en-3-yne
SpectraBase Compound ID 7yGvwN8Aw9e
InChI InChI=1S/C20H20O2S/c1-2-3-4-7-14-19(18-12-8-5-9-13-18)17-23(21,22)20-15-10-6-11-16-20/h5-6,8-13,15-17H,2-4H2,1H3/b19-17-
InChIKey ZBBWYFZCOIOMPJ-ZPHPHTNESA-N
Mol Weight 324.44 g/mol
Molecular Formula C20H20O2S
Exact Mass 324.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4pGKs5laQC
Name (E)-1-(Benzenesulfonyl)-2-phenyloct-1-en-3-yne
Alternate Name(s) [(E)-1-(benzenesulfonyl)oct-1-en-3-yn-2-yl]benzene [(1E)-1-(benzenesulfonylmethylene)hept-2-ynyl]benzene [(E)-1-(phenylsulfonyl)oct-1-en-3-yn-2-yl]benzene
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Formula C20H20O2S
InChI InChI=1S/C20H20O2S/c1-2-3-4-7-14-19(18-12-8-5-9-13-18)17-23(21,22)20-15-10-6-11-16-20/h5-6,8-13,15-17H,2-4H2,1H3/b19-17-
InChIKey ZBBWYFZCOIOMPJ-ZPHPHTNESA-N
Molecular Weight 324.438 g/mol
SMILES C(\C(=C\S(=O)(=O)c1ccccc1)c1ccccc1)#CCCCC
SPLASH splash10-002f-9702000000-623d03b618b2d5876b13
Source of Spectrum U1-2012-834-3e
Wiley ID 1705464