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[(6E,10E)-12-(2,6-Dihydroxy-4-methylphenyl)-2,6,10-trimethyldodeca-2,6,10-trien-5-yl] acetate, 2ac derivative
SpectraBase Compound ID 69d50Mx8Nlg
InChI InChI=1S/C28H38O6/c1-18(2)12-15-26(32-22(6)29)21(5)11-9-10-19(3)13-14-25-27(33-23(7)30)16-20(4)17-28(25)34-24(8)31/h11-13,16-17,26H,9-10,14-15H2,1-8H3/b19-13+,21-11+
InChIKey OUCLEQICMOQCQR-VXSWUBFMSA-N
Mol Weight 470.6 g/mol
Molecular Formula C28H38O6
Exact Mass 470.266839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IHtYaWvZJVc
Name [(6E,10E)-12-(2,6-Dihydroxy-4-methylphenyl)-2,6,10-trimethyldodeca-2,6,10-trien-5-yl] acetate, 2ac derivative
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 470.266838938 u
Formula C28H38O6
InChI InChI=1S/C28H38O6/c1-18(2)12-15-26(32-22(6)29)21(5)11-9-10-19(3)13-14-25-27(33-23(7)30)16-20(4)17-28(25)34-24(8)31/h11-13,16-17,26H,9-10,14-15H2,1-8H3/b19-13+,21-11+
InChIKey OUCLEQICMOQCQR-VXSWUBFMSA-N
Molecular Weight 470.606 g/mol
SMILES C1=C(C=C(C(=C1OC(=O)C)C\C=C\(CC\C=C\(C(CC=C(C)C)OC(=O)C)C)C)OC(=O)C)C