| SpectraBase Spectrum ID |
I86A63Gamx5 |
| Name |
Cholestan-3-one, 2-(dimethylamino)-, (2.beta.,5.alpha.)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
429.397065265 u |
| Formula |
C29H51NO |
| InChI |
InChI=1S/C29H51NO/c1-19(2)9-8-10-20(3)23-13-14-24-22-12-11-21-17-27(31)26(30(6)7)18-29(21,5)25(22)15-16-28(23,24)4/h19-26H,8-18H2,1-7H3 |
| InChIKey |
USRNBDRPPOMONI-UHFFFAOYSA-N |
| Molecular Weight |
429.733 g/mol |
| SMILES |
C[C@]12[C@@]3([C@]([C@]4([C@@](CC3)(C)[C@@]([C@@](CCCC(C)C)(C)[H])(CC4)[H])[H])(CC[C@]2(CC([C@](C1)(N(C)C)[H])=O)[H])[H])[H] |
