| SpectraBase Compound ID | 53sX6SN2aen |
|---|---|
| InChI | InChI=1S/C29H52O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h19-26,30H,8-18H2,1-7H3 |
| InChIKey | PCWHWFOTXAIVFT-UHFFFAOYSA-N |
| Mol Weight | 416.7 g/mol |
| Molecular Formula | C29H52O |
| Exact Mass | 416.401816 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 | Jn4l2yjZlNJ |
|---|---|
| Name | 4,4-Dimethylcholestan-3-ol |
| CAS Registry Number | 2550-84-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C29H52O |
| InChI | InChI=1S/C29H52O/c1-19(2)9-8-10-20(3)22-12-13-23-21-11-14-25-27(4,5)26(30)16-18-29(25,7)24(21)15-17-28(22,23)6/h19-26,30H,8-18H2,1-7H3 |
| InChIKey | PCWHWFOTXAIVFT-UHFFFAOYSA-N |
| Molecular Weight | 416.734 g/mol |
| SMILES | OC1CCC2(C(C1(C)C)CCC1C3C(CCC21)(C(C(C)CCCC(C)C)CC3)C)C |
| SPLASH | splash10-0a4l-8930000000-797c081a8685fc911206 |
| Source of Spectrum | W5-0-0-0 |
| Synonyms | 17-(1,5-dimethylhexyl)-4,4,10,13-tetramethyl-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol 4,4,10,13-tetramethyl-17-(6-methylheptan-2-yl)-1,2,3,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-ol Cholestan-3-ol, 4,4-dimethyl-, (3.beta.,5.alpha.)- |
| Wiley ID | 1376698 |