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16,17-Dihydroxy-7-kauranone, tms derivative

View entire compound with spectra: 1 NMR

16,17-Dihydroxy-7-kauranone, tms derivative
SpectraBase Compound ID 6Ripbl7KXS6
InChI InChI=1S/C23H40O3Si/c1-20(2)10-7-11-21(3)17-9-8-16-13-22(17,19(24)12-18(20)21)14-23(16,25)15-26-27(4,5)6/h16-18,25H,7-15H2,1-6H3/t16-,17+,18-,21+,22-,23+/m1/s1
InChIKey VMCICDVFVFXXQO-HVJAJDJMSA-N
Mol Weight 392.7 g/mol
Molecular Formula C23H40O3Si
Exact Mass 392.274672 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CpdKnaghfbG
Name 16,17-Dihydroxy-7-kauranone, tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 392.274671680 u
Formula C23H40O3Si
InChI InChI=1S/C23H40O3Si/c1-20(2)10-7-11-21(3)17-9-8-16-13-22(17,19(24)12-18(20)21)14-23(16,25)15-26-27(4,5)6/h16-18,25H,7-15H2,1-6H3/t16-,17+,18-,21+,22-,23+/m1/s1
InChIKey VMCICDVFVFXXQO-HVJAJDJMSA-N
Molecular Weight 392.655 g/mol
SMILES C([C@@]1([C@]2(C[C@@]3(C(C[C@@]4(C(CCC[C@@]4(C)[C@]3([H])CC2)(C)C)[H])=O)C1)[H])O)O[Si](C)(C)C