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Dihydrocubebin, 2tms derivative
SpectraBase Compound ID 81OawAFLWOc
InChI InChI=1S/C26H38O6Si2/c1-33(2,3)31-15-21(11-19-7-9-23-25(13-19)29-17-27-23)22(16-32-34(4,5)6)12-20-8-10-24-26(14-20)30-18-28-24/h7-10,13-14,21-22H,11-12,15-18H2,1-6H3/t21-,22-/m0/s1
InChIKey PYJWIOVAOKXONH-VXKWHMMOSA-N
Mol Weight 502.8 g/mol
Molecular Formula C26H38O6Si2
Exact Mass 502.220692 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C9dZ4yGsMvQ
Name Dihydrocubebin, 2tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 502.220692008 u
Formula C26H38O6Si2
InChI InChI=1S/C26H38O6Si2/c1-33(2,3)31-15-21(11-19-7-9-23-25(13-19)29-17-27-23)22(16-32-34(4,5)6)12-20-8-10-24-26(14-20)30-18-28-24/h7-10,13-14,21-22H,11-12,15-18H2,1-6H3/t21-,22-/m0/s1
InChIKey PYJWIOVAOKXONH-VXKWHMMOSA-N
Molecular Weight 502.754 g/mol
SMILES C([C@@]([C@](CO[Si](C)(C)C)(CC1=CC=C2OCOC2=C1)[H])(CC1=CC=C2OCOC2=C1)[H])O[Si](C)(C)C