| SpectraBase Compound ID | 6eBzg7jnxhC |
|---|---|
| InChI | InChI=1S/C27H42F2O3/c1-17(12-14-27(28,29)25(3,4)32)21-10-11-22-20(7-6-13-26(21,22)5)9-8-19-15-23(30)18(2)24(31)16-19/h8-9,17,21-24,30-32H,2,6-7,10-16H2,1,3-5H3/b20-9+/t17-,21-,22+,23-,24-,26-/m1/s1 |
| InChIKey | RFGCDSADQPSTSR-PXIOBPQKSA-N |
| Mol Weight | 452.6 g/mol |
| Molecular Formula | C27H42F2O3 |
| Exact Mass | 452.310202 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 | FpBi4d38U4w |
|---|---|
| Name | (20R)-1.alpha.,25-Dihydroxy-24,24-difluoro-2-methylene-19-norvitamin D3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H42F2O3 |
| InChI | InChI=1S/C27H42F2O3/c1-17(12-14-27(28,29)25(3,4)32)21-10-11-22-20(7-6-13-26(21,22)5)9-8-19-15-23(30)18(2)24(31)16-19/h8-9,17,21-24,30-32H,2,6-7,10-16H2,1,3-5H3/b20-9+/t17-,21-,22+,23-,24-,26-/m1/s1 |
| InChIKey | RFGCDSADQPSTSR-PXIOBPQKSA-N |
| Instrument Name | Micromass AutoSpec |
| Ionization Type | EI |
| Molecular Weight | 452.627 g/mol |
| SMILES | O[C@@]1(CC(C[C@](C1=C)(O)[H])=C\C=C\1[C@]2([C@](CCC1)([C@](CC2)([C@](C)(CCC(C(O)(C)C)(F)F)[H])[H])C)[H])[H] |
| SPLASH | splash10-0006-9620100000-f7fb79bebed925ecbdec |
| Source of Spectrum | US20160347710A1 |
| Wiley ID | 1853188 |