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(E)-1-(p-Toluenesulfonyl)-3,7,11,15,19-pentamethyleicosa-2,6,10,14,18-pentaene
SpectraBase Compound ID LGmo7wgZRS2
InChI InChI=1S/C32H48O2S/c1-26(2)12-8-13-27(3)14-9-15-28(4)16-10-17-29(5)18-11-19-30(6)24-25-35(33,34)32-22-20-31(7)21-23-32/h12,14,16,18,20-24H,8-11,13,15,17,19,25H2,1-7H3/b27-14+,28-16+,29-18+,30-24+
InChIKey ZUVFSVIEYWRDJB-QZJOIKOGSA-N
Mol Weight 496.8 g/mol
Molecular Formula C32H48O2S
Exact Mass 496.337502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EunHLP5SnGP
Name (E)-1-(p-Toluenesulfonyl)-3,7,11,15,19-pentamethyleicosa-2,6,10,14,18-pentaene
Alternate Name(s) 1-Methyl-4-[(2E,6E,10E,14E)-3,7,11,15,19-pentamethyleicosa-2,6,10,14,18-pentaenyl]sulfonylbenzene 1-Methyl-4-[(2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaenyl]sulfonylbenzene 1-Methyl-4-[(2E,6E,10E,14E)-3,7,11,15,19-pentamethylicosa-2,6,10,14,18-pentaenyl]sulfonyl-benzene
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Formula C32H48O2S
InChI InChI=1S/C32H48O2S/c1-26(2)12-8-13-27(3)14-9-15-28(4)16-10-17-29(5)18-11-19-30(6)24-25-35(33,34)32-22-20-31(7)21-23-32/h12,14,16,18,20-24H,8-11,13,15,17,19,25H2,1-7H3/b27-14+,28-16+,29-18+,30-24+
InChIKey ZUVFSVIEYWRDJB-QZJOIKOGSA-N
Molecular Weight 496.794 g/mol
SMILES c1(S(C\C=C\(CC\C=C\(CC\C=C\(CC\C=C\(CCC=C(C)C)C)C)C)C)(=O)=O)ccc(cc1)C
SPLASH splash10-0159-9200000000-a3e0036d239ca40a99fe
Source of Spectrum C-121-11671-54
Wiley ID 1700349