| SpectraBase Compound ID | Aw9uwwrExEu |
|---|---|
| InChI | InChI=1S/C44H62OSi/c1-32(2)33(3)22-23-35(5)41-28-29-42-36(17-16-30-44(41,42)9)25-26-37-31-38(27-24-34(37)4)45-46(43(6,7)8,39-18-12-10-13-19-39)40-20-14-11-15-21-40/h10-15,18-23,25-26,32-33,35,38,41-42H,4,16-17,24,27-31H2,1-3,5-9H3/b23-22+,36-25+,37-26+/t33-,35+,38-,41?,42?,44?/m0/s1 |
| InChIKey | QEVMAWHDTWLKMM-DYDFCPNFSA-N |
| Mol Weight | 635.1 g/mol |
| Molecular Formula | C44H62OSi |
| Exact Mass | 634.456993 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8KBdQzFvLk8 |
|---|---|
| Name | (5E)-Vitamin D2 3-tert-Butyldiphenylsilyl Ether |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C44H62OSi |
| InChI | InChI=1S/C44H62OSi/c1-32(2)33(3)22-23-35(5)41-28-29-42-36(17-16-30-44(41,42)9)25-26-37-31-38(27-24-34(37)4)45-46(43(6,7)8,39-18-12-10-13-19-39)40-20-14-11-15-21-40/h10-15,18-23,25-26,32-33,35,38,41-42H,4,16-17,24,27-31H2,1-3,5-9H3/b23-22+,36-25+,37-26+/t33-,35+,38-,41?,42?,44?/m0/s1 |
| InChIKey | QEVMAWHDTWLKMM-DYDFCPNFSA-N |
| Molecular Weight | 635.064 g/mol |
| SMILES | C12(C(\C(=C\C=C\3C(CC[C@](O[Si](C(C)(C)C)(c4ccccc4)c4ccccc4)(C3)[H])=C)CCC2)CCC1[C@@](\C=C\[C@@](C(C)C)(C)[H])(C)[H])C |
| SPLASH | splash10-000t-0802039000-43568e7dbcd7235b3118 |
| Source of Spectrum | E2-49-314-4 |
| Wiley ID | 1555652 |