| SpectraBase Spectrum ID |
HYVvN5hpKvm |
| Name |
3-METHYLCHOLESTAN-3-OL |
| CAS Registry Number |
1251-59-8 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
402.386166229 u |
| Formula |
C28H50O |
| InChI |
InChI=1S/C28H50O/c1-19(2)8-7-9-20(3)23-12-13-24-22-11-10-21-18-26(4,29)16-17-27(21,5)25(22)14-15-28(23,24)6/h19-25,29H,7-18H2,1-6H3/t20-,21?,22+,23-,24+,25+,26?,27+,28-/m1/s1 |
| InChIKey |
OSPYNJYSTBNWEX-QFVYFAIWSA-N |
| Molecular Weight |
402.707 g/mol |
| Nominal Mass |
402 u |
| Number of Peaks |
304 |
| SMILES |
OC1(CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CCC2C1)[H])[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])C)C |
| SPLASH |
splash10-005c-7982100000-f5c99e5c3617ceeb3a5c |
| Source File Reference |
LMCM-73642-839W |
| Source of Spectrum |
Prof. J. Seibl; ETH Zurich, Switzerland |
| Synonyms |
(1S,2S,10R,11S,14R,15R)-2,5,15-trimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-ol |
| Wiley ID |
8_13037 |
