| SpectraBase Compound ID | 8z7YGjV1zC5 |
|---|---|
| InChI | InChI=1S/C24H38O3Si/c1-23(2,3)28(5,6)27-16-8-10-17-15(13-16)7-9-19-18(17)11-12-24(4)20(19)14-21(25)22(24)26/h8,10,13,18-22,25-26H,7,9,11-12,14H2,1-6H3 |
| InChIKey | ZDCOBYUYWHTUDE-UHFFFAOYSA-N |
| Mol Weight | 402.7 g/mol |
| Molecular Formula | C24H38O3Si |
| Exact Mass | 402.259022 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 62I1KRHXwlO |
|---|---|
| Name | Estriol, tbdms derivative |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 402.259021616 u |
| Formula | C24H38O3Si |
| InChI | InChI=1S/C24H38O3Si/c1-23(2,3)28(5,6)27-16-8-10-17-15(13-16)7-9-19-18(17)11-12-24(4)20(19)14-21(25)22(24)26/h8,10,13,18-22,25-26H,7,9,11-12,14H2,1-6H3 |
| InChIKey | ZDCOBYUYWHTUDE-UHFFFAOYSA-N |
| Molecular Weight | 402.650 g/mol |
| SMILES | C12(C(C3CCC4=C(C3CC1)C=CC(=C4)O[Si](C(C)(C)C)(C)C)CC(C2O)O)C |