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(E)-4-methyl-2-(phenylsulfonyl)-1,3,9-decatriene
SpectraBase Compound ID 4obGYg0CIrA
InChI InChI=1S/C17H22O2S/c1-4-5-6-8-11-15(2)14-16(3)20(18,19)17-12-9-7-10-13-17/h4,7,9-10,12-14H,1,3,5-6,8,11H2,2H3/b15-14+
InChIKey MMZLRWYFWOHXSX-CCEZHUSRSA-N
Mol Weight 290.42 g/mol
Molecular Formula C17H22O2S
Exact Mass 290.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OhUCeWPtwK
Name (E)-4-methyl-2-(phenylsulfonyl)-1,3,9-decatriene
Alternate Name(s) (2E)-3-methyl-1-methylene-2,8-nonadienyl phenyl sulfone {[(2E)-3-methyl-1-methylene-2,8-nonadienyl]sulfonyl}benzene
CAS Registry Number 124243-79-4
Comments Less than 3 mono-isotopic peaks
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Formula C17H22O2S
InChI InChI=1S/C17H22O2S/c1-4-5-6-8-11-15(2)14-16(3)20(18,19)17-12-9-7-10-13-17/h4,7,9-10,12-14H,1,3,5-6,8,11H2,2H3/b15-14+
InChIKey MMZLRWYFWOHXSX-CCEZHUSRSA-N
Molecular Weight 290.421 g/mol
SMILES C(S(=O)(=O)c1ccccc1)(\C=C\(CCCCC=C)C)=C
SPLASH splash10-0002-0910000000-82412fa00dc930298a91
Source of Spectrum J-55-1274-14
Wiley ID 1293680