| SpectraBase Spectrum ID |
5IWgb7Fv7Ls |
| Name |
2-Phenanthrenecarboxylic acid, 4B,5,6,7,8,8A,9,10-octahydro-3,4B,8,8-tetramethyl-7,10-dioxo-, methyl ester, (4bs-trans)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
328.167459249 u |
| Formula |
C20H24O4 |
| InChI |
InChI=1S/C20H24O4/c1-11-8-14-13(9-12(11)18(23)24-5)15(21)10-16-19(2,3)17(22)6-7-20(14,16)4/h8-9,16H,6-7,10H2,1-5H3/t16-,20+/m0/s1 |
| InChIKey |
ZXQKFIKRKMZFHC-OXJNMPFZSA-N |
| Molecular Weight |
328.408 g/mol |
| SMILES |
[C@]12(C=3C(=CC(=C(C3)C)C(=O)OC)C(C[C@]1(C(C)(C)C(CC2)=O)[H])=O)C |
