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2,6-Octadienoic acid, 3,7-dimethyl-8-(4-methyl-2-furanyl)-, 3-furanylmethyl ester, (E,E)-
SpectraBase Compound ID 8Z1bIvOG7Vv
InChI InChI=1S/C20H24O4/c1-15(9-19-10-17(3)12-23-19)5-4-6-16(2)11-20(21)24-14-18-7-8-22-13-18/h5,7-8,10-13H,4,6,9,14H2,1-3H3/b15-5+,16-11+
InChIKey WMZXPVNHOWYKDN-SKJRKUQSSA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AXw81YhJmS4
Name 2,6-Octadienoic acid, 3,7-dimethyl-8-(4-methyl-2-furanyl)-, 3-furanylmethyl ester, (E,E)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.167459249 u
Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-15(9-19-10-17(3)12-23-19)5-4-6-16(2)11-20(21)24-14-18-7-8-22-13-18/h5,7-8,10-13H,4,6,9,14H2,1-3H3/b15-5+,16-11+
InChIKey WMZXPVNHOWYKDN-SKJRKUQSSA-N
Molecular Weight 328.408 g/mol
SMILES C=1(OC=C(C1)C)C\C(=C\CC\C(=C\C(=O)OCC1=COC=C1)C)C