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(+)-(S)-methyl 2,4-dimethoxy-6-(8-hydroxynonyl)benzoate
SpectraBase Compound ID 80JX8VrkNIl
InChI InChI=1S/C19H30O5/c1-14(20)10-8-6-5-7-9-11-15-12-16(22-2)13-17(23-3)18(15)19(21)24-4/h12-14,20H,5-11H2,1-4H3/t14-/m0/s1
InChIKey VZMZLXLATAGCAG-AWEZNQCLSA-N
Mol Weight 338.44 g/mol
Molecular Formula C19H30O5
Exact Mass 338.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8oiff4jLnu1
Name (+)-(S)-methyl 2,4-dimethoxy-6-(8-hydroxynonyl)benzoate
Comments Computed using HOSE algorithm
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Exact Mass 338.209324061 u
Formula C19H30O5
InChI InChI=1S/C19H30O5/c1-14(20)10-8-6-5-7-9-11-15-12-16(22-2)13-17(23-3)18(15)19(21)24-4/h12-14,20H,5-11H2,1-4H3/t14-/m0/s1
InChIKey VZMZLXLATAGCAG-AWEZNQCLSA-N
Molecular Weight 338.444 g/mol
SMILES C1(=C(C=C(C=C1CCCCCCC[C@@](O)(C)[H])OC)OC)C(=O)OC