| SpectraBase Compound ID | DOM7gtVZWVj |
|---|---|
| InChI | InChI=1S/C44H66O3Si/c1-9-37-40(45)30-33(24-25-34-19-17-29-44(8)38(26-27-39(34)44)32(2)18-16-28-43(6,7)46)31-41(37)47-48(42(3,4)5,35-20-12-10-13-21-35)36-22-14-11-15-23-36/h10-15,20-25,32,37-41,45-46H,9,16-19,26-31H2,1-8H3/b33-24-,34-25+/t32-,37-,38-,39+,40-,41-,44-/m1/s1 |
| InChIKey | KQFQKZXDSJHKFV-SHJBQEELSA-N |
| Mol Weight | 671.1 g/mol |
| Molecular Formula | C44H66O3Si |
| Exact Mass | 670.478123 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | ES5BGlXkfJn |
|---|---|
| Name | 2.beta.-Ethyl-1.alpha.-t-butyldiphenylsilyloxy-25-dihydroxy-19-norvitamin D3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C44H66O3Si |
| InChI | InChI=1S/C44H66O3Si/c1-9-37-40(45)30-33(24-25-34-19-17-29-44(8)38(26-27-39(34)44)32(2)18-16-28-43(6,7)46)31-41(37)47-48(42(3,4)5,35-20-12-10-13-21-35)36-22-14-11-15-23-36/h10-15,20-25,32,37-41,45-46H,9,16-19,26-31H2,1-8H3/b33-24-,34-25+/t32-,37-,38-,39+,40-,41-,44-/m1/s1 |
| InChIKey | KQFQKZXDSJHKFV-SHJBQEELSA-N |
| Molecular Weight | 671.094 g/mol |
| SMILES | O[C@]1([C@]([C@@](C\C(=C/C=C/2[C@]3([C@@]([C@@]([C@@](CCCC(O)(C)C)(C)[H])(CC3)[H])(CCC2)C)[H])C1)(O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1)[H])(CC)[H])[H] |
| SPLASH | splash10-052b-5900000000-7b73f151e89a1259c493 |
| Source of Spectrum | QE-19-172-22 |
| Wiley ID | 1584973 |