| SpectraBase Spectrum ID |
6pVEd43udj7 |
| Name |
1,1,4A-Trimethyl-7-hydroxy-7-isopropyl-9-oxo-[perhydro-.delta(8,8A).]-phenanthrene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.240230268 u |
| Formula |
C20H32O2 |
| InChI |
InChI=1S/C20H32O2/c1-13(2)20(22)10-7-15-14(12-20)16(21)11-17-18(3,4)8-6-9-19(15,17)5/h12-13,15,17,22H,6-11H2,1-5H3/t15?,17?,19-,20+/m0/s1 |
| InChIKey |
SWTZTWQASUSBIY-FCUIKFHKSA-N |
| Molecular Weight |
304.474 g/mol |
| SMILES |
C1=2C([C@]3(C(C(C)(C)CCC3)CC1=O)C)CC[C@@](C2)(C(C)C)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938989 |
![1,1,4A-Trimethyl-7-hydroxy-7-isopropyl-9-oxo-[perhydro-.delta(8,8A).]-phenanthrene](/api/spectrum/6pVEd43udj7/structure.png?h=300&w=458 "1,1,4A-Trimethyl-7-hydroxy-7-isopropyl-9-oxo-[perhydro-.delta(8,8A).]-phenanthrene")
