| SpectraBase Compound ID | 8CUzUMOML6k |
|---|---|
| InChI | InChI=1S/C38H70O6Si/c1-29(14-12-20-37(5,6)43-28-40-9)34-18-19-35-31(15-13-21-38(34,35)7)17-16-30-24-32(26-33(25-30)42-27-39-8)41-22-23-44-45(10,11)36(2,3)4/h16-17,29,32-35H,12-15,18-28H2,1-11H3/b30-16+,31-17+/t29-,32-,33-,34-,35+,38-/m1/s1 |
| InChIKey | IFZDDIWVUDPZBV-KJRIQLOMSA-N |
| Mol Weight | 651.1 g/mol |
| Molecular Formula | C38H70O6Si |
| Exact Mass | 650.494167 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DYmMf3EwK7X |
|---|---|
| Name | 1.alpha.-{(2-tert-Butyldimethylsilyloxy)-ethyloxy}-25-(methoxymethoxy)-19-norvitamin D3 3-Methoxymethyl Ether |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H70O6Si |
| InChI | InChI=1S/C38H70O6Si/c1-29(14-12-20-37(5,6)43-28-40-9)34-18-19-35-31(15-13-21-38(34,35)7)17-16-30-24-32(26-33(25-30)42-27-39-8)41-22-23-44-45(10,11)36(2,3)4/h16-17,29,32-35H,12-15,18-28H2,1-11H3/b30-16+,31-17+/t29-,32-,33-,34-,35+,38-/m1/s1 |
| InChIKey | IFZDDIWVUDPZBV-KJRIQLOMSA-N |
| Instrument Name | JEOL JMSAX505HA |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/jm400537h |
| Molecular Weight | 651.057 g/mol |
| SMILES | C1\C(C[C@](C[C@@]1(OCOC)[H])(OCCO[Si](C(C)(C)C)(C)C)[H])=C\C=C/1CCC[C@]2([C@]1(CC[C@@]2([C@](C)(CCCC(OCOC)(C)C)[H])[H])[H])C |
| SPLASH | splash10-00di-9000000000-baf50dc9ddd857785775 |
| Source of Spectrum | AF-56-6755-13 |
| Wiley ID | 1854580 |