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(1E,3Z)-1-Phenyl-3-phenylsulfonyl-1,3-octadiene
SpectraBase Compound ID Awb00KNSMRi
InChI InChI=1S/C20H22O2S/c1-2-3-6-13-20(17-16-18-11-7-4-8-12-18)23(21,22)19-14-9-5-10-15-19/h4-5,7-17H,2-3,6H2,1H3/b17-16+,20-13-
InChIKey LJZMJTOUGCVVIK-QALJOLJYSA-N
Mol Weight 326.45 g/mol
Molecular Formula C20H22O2S
Exact Mass 326.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tSoFOLMk1o
Name (1E,3Z)-1-Phenyl-3-phenylsulfonyl-1,3-octadiene
Alternate Name(s) (((1E,3Z)-1-phenylocta-1,3-dien-3-yl)sulfonyl)benzene [(1E,3Z)-3-(benzenesulfonyl)octa-1,3-dienyl]benzene [(1E,3Z)-3-(phenylsulfonyl)octa-1,3-dienyl]benzene
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Formula C20H22O2S
InChI InChI=1S/C20H22O2S/c1-2-3-6-13-20(17-16-18-11-7-4-8-12-18)23(21,22)19-14-9-5-10-15-19/h4-5,7-17H,2-3,6H2,1H3/b17-16+,20-13-
InChIKey LJZMJTOUGCVVIK-QALJOLJYSA-N
Literature Reference DOI 10.1002/cjoc.200790355
Molecular Weight 326.454 g/mol
SMILES c1(S(=O)(\C(=C/CCCC)\C=C\c2ccccc2)=O)ccccc1
SPLASH splash10-002f-9400000000-a31f2533a83bc1a23770
Source of Spectrum CJC-25-1929-3b
Wiley ID 1774407