| SpectraBase Spectrum ID |
8HoMzR1JanN |
| Name |
2,2-Dimethyl-3-oxa-5.alpha.-cholestane |
| CAS Registry Number |
83626-01-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H50O |
| InChI |
InChI=1S/C28H50O/c1-19(2)9-8-10-20(3)23-13-14-24-22-12-11-21-17-29-26(4,5)18-28(21,7)25(22)15-16-27(23,24)6/h19-25H,8-18H2,1-7H3/t20-,21+,22+,23-,24+,25+,27-,28+/m1/s1 |
| InChIKey |
HBSMQUXQKGQNCP-PXYXKYBDSA-N |
| Molecular Weight |
402.707 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC(C)(C)OC4)C)[H])[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH |
splash10-000i-0009000000-702f4c529e3aa527acc6 |
| Source of Spectrum |
J-49-3760-0 |
| Synonyms |
(4aR,4bS,6aR,7R,9aS,9bS,11aR)-7-[(1R)-1,5-dimethylhexyl]-3,3,4a,6a-tetramethylhexadecahydrocyclopenta[5,6]naphtho[2,1-c]pyran |
| Wiley ID |
1370736 |
