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(9R*,6E,13E)-9-[(4S*)-2,2-Dimethyl-1,3-dioxolane-4-yl]-2,6,14,18-tetramethyl-2,6,13,17-nonadecatetraen-10-one
SpectraBase Compound ID JiTWpV9hMWc
InChI InChI=1S/C28H46O3/c1-21(2)12-9-14-23(5)16-11-17-26(29)25(27-20-30-28(7,8)31-27)19-18-24(6)15-10-13-22(3)4/h12-13,16,18,25,27H,9-11,14-15,17,19-20H2,1-8H3/b23-16+,24-18+/t25-,27+/m0/s1
InChIKey DWYDTLJFMZMHAS-DWGNKCGDSA-N
Mol Weight 430.7 g/mol
Molecular Formula C28H46O3
Exact Mass 430.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AkLAqW6AdcR
Name (9R*,6E,13E)-9-[(4S*)-2,2-Dimethyl-1,3-dioxolane-4-yl]-2,6,14,18-tetramethyl-2,6,13,17-nonadecatetraen-10-one
Comments Computed using HOSE algorithm
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Exact Mass 430.344695338 u
Formula C28H46O3
InChI InChI=1S/C28H46O3/c1-21(2)12-9-14-23(5)16-11-17-26(29)25(27-20-30-28(7,8)31-27)19-18-24(6)15-10-13-22(3)4/h12-13,16,18,25,27H,9-11,14-15,17,19-20H2,1-8H3/b23-16+,24-18+/t25-,27+/m0/s1
InChIKey DWYDTLJFMZMHAS-DWGNKCGDSA-N
Molecular Weight 430.673 g/mol
SMILES C1(O[C@](CO1)([C@@](C\C=C\(CCC=C(C)C)C)(C(=O)CC\C=C\(CCC=C(C)C)C)[H])[H])(C)C