| SpectraBase Spectrum ID |
IuLL735pv0L |
| Name |
3-Phenanthrenol, 4B,5,6,7,8,8A,9,10-octahydro-4B,8-dimethyl-, acetate, [4bs-(4B.alpha.,8.alpha.,8A.beta.)]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
272.177630011 u |
| Formula |
C18H24O2 |
| InChI |
InChI=1S/C18H24O2/c1-12-5-4-10-18(3)16(12)9-7-14-6-8-15(11-17(14)18)20-13(2)19/h6,8,11-12,16H,4-5,7,9-10H2,1-3H3/t12-,16-,18+/m1/s1 |
| InChIKey |
LNOINJLPZBBQJW-NJAPINKUSA-N |
| SMILES |
[C@]12(C3=C(C=CC(=C3)OC(=O)C)CC[C@@]1([C@](C)(CCC2)[H])[H])C |
![3-Phenanthrenol, 4b,5,6,7,8,8a,9,10-octahydro-4b,8-dimethyl-, acetate, [4bS-(4b.alpha.,8.alpha.,8a.beta.)]-](/api/spectrum/IuLL735pv0L/structure.png?h=300&w=458 "3-Phenanthrenol, 4b,5,6,7,8,8a,9,10-octahydro-4b,8-dimethyl-, acetate, [4bS-(4b.alpha.,8.alpha.,8a.beta.)]-")
