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7-[(2E)-4-Hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one, acetate
SpectraBase Compound ID 9EekuXlZynI
InChI InChI=1S/C21H24O5/c1-14(2)5-9-19(25-16(4)22)15(3)11-12-24-18-8-6-17-7-10-21(23)26-20(17)13-18/h5-8,10-11,13,19H,9,12H2,1-4H3/b15-11+
InChIKey FWGZMIWIKPVWGR-RVDMUPIBSA-N
Mol Weight 356.42 g/mol
Molecular Formula C21H24O5
Exact Mass 356.162374 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HiPG5fxwxDh
Name 7-[(2E)-4-Hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one, acetate
Comments Computed using HOSE algorithm
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Exact Mass 356.162373868 u
Formula C21H24O5
InChI InChI=1S/C21H24O5/c1-14(2)5-9-19(25-16(4)22)15(3)11-12-24-18-8-6-17-7-10-21(23)26-20(17)13-18/h5-8,10-11,13,19H,9,12H2,1-4H3/b15-11+
InChIKey FWGZMIWIKPVWGR-RVDMUPIBSA-N
Molecular Weight 356.418 g/mol
SMILES C1=C(C=C2C(=C1)C=CC(O2)=O)OC\C=C\(C(CC=C(C)C)OC(=O)C)C