| SpectraBase Spectrum ID |
BVAoz4Zhjcz |
| Name |
Adian-5-ene |
| Alternate Name(s) |
(3R,3aR,5aR,11bR,13aS)-3-isopropyl-3a,5a,8,8,11b,13a-hexamethyl-2,3,3a,4,5,5a,5b,6,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydro-1H-cyclopenta[a]chrysene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C30H50 |
| InChI |
InChI=1S/C30H50/c1-20(2)21-11-13-24-27(21,5)16-18-30(8)25-14-12-22-23(10-9-15-26(22,3)4)28(25,6)17-19-29(24,30)7/h12,20-21,23-25H,9-11,13-19H2,1-8H3/t21-,23?,24?,25?,27-,28+,29+,30-/m1/s1 |
| InChIKey |
WZDKBHGEBSMIQO-GYGSZJQCSA-N |
| Molecular Weight |
410.730 g/mol |
| SMILES |
[C@]12([C@@](C3CC=C4C([C@@]3(CC2)C)CCCC4(C)C)(CC[C@]2(C1CC[C@@]2(C(C)C)[H])C)C)C |
| SPLASH |
splash10-059i-0590000000-15704710e3abd0272a67 |
| Source of Spectrum |
E1-40-1689-22 |
| Wiley ID |
1519557 |
