| SpectraBase Compound ID | BGYZ5w6puvz |
|---|---|
| InChI | InChI=1S/C26H42O3/c1-5-20(12-14-27)17(2)22-10-11-23-21(7-6-13-26(22,23)4)9-8-19-15-24(28)18(3)25(29)16-19/h8-9,17,20,22-25,27-29H,3,5-7,10-16H2,1-2,4H3/b21-9+/t17-,20+,22-,23+,24-,25-,26-/m1/s1 |
| InChIKey | MJSNOTROAGEHAK-HSPXBGPKSA-N |
| Mol Weight | 402.6 g/mol |
| Molecular Formula | C26H42O3 |
| Exact Mass | 402.313395 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 33eRVwhWHw |
|---|---|
| Name | 22S-Ethyl-2-methylidene-19,25,26,27-tetranor-1.alpha.,24-dihydroxyvitamin D3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H42O3 |
| InChI | InChI=1S/C26H42O3/c1-5-20(12-14-27)17(2)22-10-11-23-21(7-6-13-26(22,23)4)9-8-19-15-24(28)18(3)25(29)16-19/h8-9,17,20,22-25,27-29H,3,5-7,10-16H2,1-2,4H3/b21-9+/t17-,20+,22-,23+,24-,25-,26-/m1/s1 |
| InChIKey | MJSNOTROAGEHAK-HSPXBGPKSA-N |
| Instrument Name | a JEOL JMS D-300 and JEOL JMS-HX110A |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/jm100649d |
| Molecular Weight | 402.619 g/mol |
| Reported Formula | C26H42O3 |
| SMILES | O[C@@]1(CC(C[C@](C1=C)(O)[H])=C\C=C\1[C@]2([C@](CCC1)([C@](CC2)([C@@]([C@](CCO)(CC)[H])(C)[H])[H])C)[H])[H] |
| SPLASH | splash10-0i0a-3910100000-eb4e4528022829c189a2 |
| Source of Spectrum | AF-53-5822-3b |
| Wiley ID | 1846230 |