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Licorisoflavan A, 2tms derivative

View entire compound with spectra: 1 NMR

Licorisoflavan A, 2tms derivative
SpectraBase Compound ID 3cGi29VdUcF
InChI InChI=1S/C33H50O5Si2/c1-22(2)13-15-26-29(37-39(7,8)9)18-17-25(33(26)38-40(10,11)12)24-19-28-31(36-21-24)20-30(34-5)27(32(28)35-6)16-14-23(3)4/h13-14,17-18,20,24H,15-16,19,21H2,1-12H3/t24-/m0/s1
InChIKey FHXUMIXUBOARAN-DEOSSOPVSA-N
Mol Weight 582.9 g/mol
Molecular Formula C33H50O5Si2
Exact Mass 582.319678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bbWjVMpYm2
Name Licorisoflavan A, 2tms derivative
Comments Computed using HOSE algorithm
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Exact Mass 582.319677775 u
Formula C33H50O5Si2
InChI InChI=1S/C33H50O5Si2/c1-22(2)13-15-26-29(37-39(7,8)9)18-17-25(33(26)38-40(10,11)12)24-19-28-31(36-21-24)20-30(34-5)27(32(28)35-6)16-14-23(3)4/h13-14,17-18,20,24H,15-16,19,21H2,1-12H3/t24-/m0/s1
InChIKey FHXUMIXUBOARAN-DEOSSOPVSA-N
Molecular Weight 582.928 g/mol
SMILES C1(=C(C(=C(C=C1)[C@@]1(COC2=C(C1)C(OC)=C(C(=C2)OC)CC=C(C)C)[H])O[Si](C)(C)C)CC=C(C)C)O[Si](C)(C)C