SpectraBase Spectrum ID |
6oOszliqfw4 |
Name |
5.ALPHA.-CHOLESTAN |
CAS Registry Number |
481-21-0 |
Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
372.375601546 u |
Formula |
C27H48 |
InChI |
InChI=1S/C27H48/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h19-25H,6-18H2,1-5H3/t20-,21-,22+,23-,24+,25+,26+,27-/m1/s1 |
InChIKey |
XIIAYQZJNBULGD-XWLABEFZSA-N |
Molecular Weight |
372.681 g/mol |
Nominal Mass |
372 u |
Number of Peaks |
79 |
SMILES |
C1CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CC[C@]2(C1)[H])[H])[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])C |
SPLASH |
splash10-01ba-9655000000-e6342faa0001a3ad1037 |
Source File Reference |
LMCM-86399-887Z |
Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
Synonyms |
CHOLESTANE, (5.ALPHA.)-
CHOLESTANE
(5R,8R,9S,10S,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)hexadecahydro-1H-cyclopenta[a]phenanthrene |
Wiley ID |
4_588 |