| SpectraBase Spectrum ID |
3AbSUeHOOO |
| Name |
(3R,3aR,5aR,5bR,7aS,11aS,13aS,13bR)-3-isopropyl-3a,5a,8,8,11a,13a-hexamethyl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysene |
| Alternate Name(s) |
(3R,3aR,5aR,5bR,7aS,11aS,13aS,13bR)-3a,5a,8,8,11a,13a-hexamethyl-3-propan-2-yl-1,2,3,4,5,5b,6,7,7a,9,10,11,13,13b-tetradecahydrocyclopenta[a]chrysene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50 |
| InChI |
InChI=1S/C30H50/c1-20(2)21-10-13-25-28(21,6)18-19-29(7)23-11-12-24-26(3,4)15-9-16-27(24,5)22(23)14-17-30(25,29)8/h14,20-21,23-25H,9-13,15-19H2,1-8H3/t21-,23+,24+,25-,27-,28-,29-,30+/m1/s1 |
| InChIKey |
ZHDRLFGZQZCZKX-BQOUFORSSA-N |
| Molecular Weight |
410.730 g/mol |
| SMILES |
[C@]12([C@@]([C@]3(CC[C@@]4([C@@](C3=CC2)(CCCC4(C)C)C)[H])[H])(CC[C@]2([C@]1(CC[C@@]2(C(C)C)[H])[H])C)C)C |
| SPLASH |
splash10-0005-0097200000-884afd0ee653cf788813 |
| Source of Spectrum |
E1-40-1687-17 |
| Wiley ID |
1519582 |
