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2-[(1E,6E)-3-hydroxy-3,7,11-trimethyldodeca-1,6,10-trienyl]-4-phenylmethoxyphenol
SpectraBase Compound ID JudOjXrT56K
InChI InChI=1S/C28H36O3/c1-22(2)10-8-11-23(3)12-9-18-28(4,30)19-17-25-20-26(15-16-27(25)29)31-21-24-13-6-5-7-14-24/h5-7,10,12-17,19-20,29-30H,8-9,11,18,21H2,1-4H3/b19-17+,23-12+
InChIKey YXQVODTUEBRPFE-HTLWHMLYSA-N
Mol Weight 420.6 g/mol
Molecular Formula C28H36O3
Exact Mass 420.266445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CJikrWNbYhK
Name 2-[(1E,6E)-3-hydroxy-3,7,11-trimethyldodeca-1,6,10-trienyl]-4-phenylmethoxyphenol
Alternate Name(s) 4-Benzoxy-2-[(1E,6E)-3-hydroxy-3,7,11-trimethyl-dodeca-1,6,10-trienyl]phenol 4-Benzyloxy-2-[(1E,6E)-3-hydroxy-3,7,11-trimethyl-dodeca-1,6,10-trienyl]phenol 4-Phenylmethoxy-2-[(1E,6E)-3,7,11-trimethyl-3-oxidanyl-dodeca-1,6,10-trienyl]phenol
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Formula C28H36O3
InChI InChI=1S/C28H36O3/c1-22(2)10-8-11-23(3)12-9-18-28(4,30)19-17-25-20-26(15-16-27(25)29)31-21-24-13-6-5-7-14-24/h5-7,10,12-17,19-20,29-30H,8-9,11,18,21H2,1-4H3/b19-17+,23-12+
InChIKey YXQVODTUEBRPFE-HTLWHMLYSA-N
Molecular Weight 420.593 g/mol
SMILES Oc1c(\C=C\C(O)(CC\C=C\(CCC=C(C)C)C)C)cc(cc1)OCc1ccccc1
SPLASH splash10-0udi-4090200000-fecb4cebd67d7e0fec7c
Source of Spectrum QC-11-2415-10
Wiley ID 859886