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1,1,4,8-Tetramethyl-2-[(2'-methyl-2'-butenoyl)oxy]-5-hydroxyundeca-3,7-diene
SpectraBase Compound ID 5vkndQqVKgs
InChI InChI=1S/C20H32O3/c1-7-15(3)19(22)23-18-13-16(4)17(21)11-10-14(2)9-8-12-20(18,5)6/h7,10,13,17-18,21H,8-9,11-12H2,1-6H3/b14-10+,15-7+,16-13+
InChIKey VNKIHXUIEBJFOC-MBUCEENHSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2A2nf3C3GcO
Name 1,1,4,8-Tetramethyl-2-[(2'-methyl-2'-butenoyl)oxy]-5-hydroxyundeca-3,7-diene
Comments Computed using HOSE algorithm
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Exact Mass 320.235144887 u
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-7-15(3)19(22)23-18-13-16(4)17(21)11-10-14(2)9-8-12-20(18,5)6/h7,10,13,17-18,21H,8-9,11-12H2,1-6H3/b14-10+,15-7+,16-13+
InChIKey VNKIHXUIEBJFOC-MBUCEENHSA-N
Molecular Weight 320.473 g/mol
SMILES C(OC1\C=C\(C(C\C=C\(CCCC1(C)C)C)O)C)(\C(=C\C)C)=O