| SpectraBase Spectrum ID |
9mZRPd0kQbQ |
| Name |
5-.alpha.-Deuteriocholestan-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H45DO |
| InChI |
InChI=1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h18-20,22-25H,6-17H2,1-5H3/t19-,20+,22+,23-,24+,25+,26+,27-/m1/s1/i20D |
| InChIKey |
PESKGJQREUXSRR-FMAQJVQLSA-N |
| Molecular Weight |
387.670 g/mol |
| SMILES |
C1(CC[C@]2([C@](C1)(CC[C@]1([C@@]3(CC[C@]([C@@](CCCC(C)C)(C)[H])([C@@]3(C)CC[C@]21[H])[H])[H])[H])[2D])C)=O |
| SPLASH |
splash10-000i-0009000000-5f21fee905286f590adf |
| Source of Spectrum |
SO-0-402-0 |
| Wiley ID |
1537433 |
