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(1-Methyl-5-oxo-non-8-enyl) 2-allyl-4,6-dimethoxy-benzoate
SpectraBase Compound ID EcpWoYvpS4P
InChI InChI=1S/C22H30O5/c1-6-8-12-18(23)13-9-11-16(3)27-22(24)21-17(10-7-2)14-19(25-4)15-20(21)26-5/h6-7,14-16H,1-2,8-13H2,3-5H3
InChIKey QPHZOPZCIOEZFN-UHFFFAOYSA-N
Mol Weight 374.48 g/mol
Molecular Formula C22H30O5
Exact Mass 374.209324 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITlOg3P2Er
Name (1-Methyl-5-oxo-non-8-enyl) 2-allyl-4,6-dimethoxy-benzoate
Comments Computed using HOSE algorithm
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Exact Mass 374.209324061 u
Formula C22H30O5
InChI InChI=1S/C22H30O5/c1-6-8-12-18(23)13-9-11-16(3)27-22(24)21-17(10-7-2)14-19(25-4)15-20(21)26-5/h6-7,14-16H,1-2,8-13H2,3-5H3
InChIKey QPHZOPZCIOEZFN-UHFFFAOYSA-N
Molecular Weight 374.477 g/mol
SMILES C1(C(OC(CCCC(=O)CCC=C)C)=O)=C(C=C(C=C1CC=C)OC)OC