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1-Methyl-2-[(1Z)-1-(4-methylphenyl)sulfonylhexa-1,5-dienyl]benzene
SpectraBase Compound ID 5QlFIi7cg5m
InChI InChI=1S/C20H22O2S/c1-4-5-6-11-20(19-10-8-7-9-17(19)3)23(21,22)18-14-12-16(2)13-15-18/h4,7-15H,1,5-6H2,2-3H3/b20-11-
InChIKey VKJGGQAGADMEMU-JAIQZWGSSA-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 1M1MCStLXc
Name 1-Methyl-2-[(1Z)-1-(4-methylphenyl)sulfonylhexa-1,5-dienyl]benzene
Alternate Name(s) 1-Methyl-2-[(1Z)-1-(p-tolylsulfonyl)hexa-1,5-dienyl]benzene 1-Methyl-2-[(1Z)-1-tosylhexa-1,5-dienyl]benzene
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Formula C20H22O2S
InChI InChI=1S/C20H22O2S/c1-4-5-6-11-20(19-10-8-7-9-17(19)3)23(21,22)18-14-12-16(2)13-15-18/h4,7-15H,1,5-6H2,2-3H3/b20-11-
InChIKey VKJGGQAGADMEMU-JAIQZWGSSA-N
Molecular Weight 326.454 g/mol
SMILES c1(\C(S(c2ccc(cc2)C)(=O)=O)=C\CCC=C)c(C)cccc1
SPLASH splash10-0adi-0900000000-b6cf9b4b70245d74c470
Source of Spectrum J-63-2092-23
Wiley ID 1324935