| SpectraBase Compound ID | EtZMRy9Avda |
|---|---|
| InChI | InChI=1S/C30H42O9Si/c1-10-22(16-35-29(33)23(11-2)17-36-40(7,8)9)30(34)39-25-14-18(3)12-13-24(37-21(6)31)19(4)15-26-27(25)20(5)28(32)38-26/h10-12,15,24-27H,5,13-14,16-17H2,1-4,6-9H3/b18-12+,19-15-,22-10+,23-11+/t24-,25+,26-,27+/m0/s1 |
| InChIKey | AUFOFUHJOQBYLD-BTIQZZRESA-N |
| Mol Weight | 574.7 g/mol |
| Molecular Formula | C30H42O9Si |
| Exact Mass | 574.259809 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3drShaU0VCi |
|---|---|
| Name | 4'-Deoxyprovincialin, tms |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 574.259809458 u |
| Formula | C30H42O9Si |
| InChI | InChI=1S/C30H42O9Si/c1-10-22(16-35-29(33)23(11-2)17-36-40(7,8)9)30(34)39-25-14-18(3)12-13-24(37-21(6)31)19(4)15-26-27(25)20(5)28(32)38-26/h10-12,15,24-27H,5,13-14,16-17H2,1-4,6-9H3/b18-12+,19-15-,22-10+,23-11+/t24-,25+,26-,27+/m0/s1 |
| InChIKey | AUFOFUHJOQBYLD-BTIQZZRESA-N |
| Molecular Weight | 574.742 g/mol |
| SMILES | C1(C([C@]2([C@@](O1)(\C=C/([C@@](OC(=O)C)(C\C=C\(C[C@]2(OC(\C(COC(\C(=C\C)CO[Si](C)(C)C)=O)=C\C)=O)[H])C)[H])C)[H])[H])=C)=O |