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(([(2E,6E)-7,11-Dimethyl-5-(phenylsulfanyl)-2,6,10-dodecatrienyl]oxy)methyl)benzene
SpectraBase Compound ID 9BygFmrYsFF
InChI InChI=1S/C27H34OS/c1-23(2)13-12-14-24(3)21-27(29-26-17-8-5-9-18-26)19-10-11-20-28-22-25-15-6-4-7-16-25/h4-11,13,15-18,21,27H,12,14,19-20,22H2,1-3H3/b11-10+,24-21+
InChIKey XEJHKZZQQBRGBU-WCEJAUPPSA-N
Mol Weight 406.6 g/mol
Molecular Formula C27H34OS
Exact Mass 406.233037 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1DIx7AiW39V
Name (([(2E,6E)-7,11-Dimethyl-5-(phenylsulfanyl)-2,6,10-dodecatrienyl]oxy)methyl)benzene
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Formula C27H34OS
InChI InChI=1S/C27H34OS/c1-23(2)13-12-14-24(3)21-27(29-26-17-8-5-9-18-26)19-10-11-20-28-22-25-15-6-4-7-16-25/h4-11,13,15-18,21,27H,12,14,19-20,22H2,1-3H3/b11-10+,24-21+
InChIKey XEJHKZZQQBRGBU-WCEJAUPPSA-N
Molecular Weight 406.628 g/mol
SMILES CC(C)=CCC\C(C)=C\C(Sc1ccccc1)C\C=C\COCc1ccccc1
SPLASH splash10-0006-9400000000-92464c13e3599ca75ee9
Synonyms 2,6,10-Dodecatriene, 1-(benzyloxy)-7,11-dimethyl-5-(phenylthio) [(2E)-1-[(E)-4-benzyloxybut-2-enyl]-3,7-dimethyl-octa-2,6-dienyl]sulfanylbenzene [(2E,6E)-7,11-dimethyl-1-phenylmethoxy-dodeca-2,6,10-trien-5-yl]sulfanylbenzene [[(2E)-1-[(E)-4-benzoxybut-2-enyl]-3,7-dimethyl-octa-2,6-dienyl]thio]benzene [[(2E,6E)-7,11-dimethyl-1-phenylmethoxydodeca-2,6,10-trien-5-yl]thio]benzene
Wiley ID 1477731