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[(6E,10E)-12-(2,6-Dihydroxy-4-methylphenyl)-2,6,10-trimethyl-4-oxododeca-6,10-dien-5-yl] acetate
SpectraBase Compound ID DWnCD4Fgo4r
InChI InChI=1S/C24H34O5/c1-15(2)12-23(28)24(29-19(6)25)18(5)9-7-8-16(3)10-11-20-21(26)13-17(4)14-22(20)27/h9-10,13-15,24,26-27H,7-8,11-12H2,1-6H3/b16-10+,18-9+
InChIKey SKUHMSDGVDBXSV-VAPDIGTASA-N
Mol Weight 402.5 g/mol
Molecular Formula C24H34O5
Exact Mass 402.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5wBztqxMaKO
Name [(6E,10E)-12-(2,6-Dihydroxy-4-methylphenyl)-2,6,10-trimethyl-4-oxododeca-6,10-dien-5-yl] acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 402.240624190 u
Formula C24H34O5
InChI InChI=1S/C24H34O5/c1-15(2)12-23(28)24(29-19(6)25)18(5)9-7-8-16(3)10-11-20-21(26)13-17(4)14-22(20)27/h9-10,13-15,24,26-27H,7-8,11-12H2,1-6H3/b16-10+,18-9+
InChIKey SKUHMSDGVDBXSV-VAPDIGTASA-N
Molecular Weight 402.531 g/mol
SMILES C1=C(C=C(C(=C1O)C\C=C\(CC\C=C\(C(C(CC(C)C)=O)OC(=O)C)C)C)O)C