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2,6,10-Dodecatriene-1,12-diol, 6-(hydroxymethyl)-10-methyl-2-(4-methyl-3-penten-1-yl)-, 1-acetate

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2,6,10-Dodecatriene-1,12-diol, 6-(hydroxymethyl)-10-methyl-2-(4-methyl-3-penten-1-yl)-, 1-acetate
SpectraBase Compound ID L5bmh6BmSdO
InChI InChI=1S/C22H36O4/c1-18(2)8-5-12-22(17-26-20(4)25)13-7-11-21(16-24)10-6-9-19(3)14-15-23/h8,10,13-14,23-24H,5-7,9,11-12,15-17H2,1-4H3
InChIKey GFDOSVZSTRYXMK-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C22H36O4
Exact Mass 364.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LU5Ku488KWz
Name 2,6,10-Dodecatriene-1,12-diol, 6-(hydroxymethyl)-10-methyl-2-(4-methyl-3-penten-1-yl)-, 1-acetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 364.261359635 u
Formula C22H36O4
InChI InChI=1S/C22H36O4/c1-18(2)8-5-12-22(17-26-20(4)25)13-7-11-21(16-24)10-6-9-19(3)14-15-23/h8,10,13-14,23-24H,5-7,9,11-12,15-17H2,1-4H3
InChIKey GFDOSVZSTRYXMK-UHFFFAOYSA-N
Molecular Weight 364.526 g/mol
SMILES C(OC(=O)C)\C(CCC=C(C)C)=C/CC\C(CO)=C\CC\C(C)=C\CO