| SpectraBase Spectrum ID |
3BGjS0qZJ2u |
| Name |
8-Hydroxy-3-[[1',5'-dimethyl)hexyl]3A,5B-dimethyl-3A,4,5,5B,6,7,8,9-octahydroindano[6,7-A]naphthalene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.339216036 u |
| Formula |
C27H44O |
| InChI |
InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-11,18-22,24-25,28H,6-8,12-17H2,1-5H3 |
| InChIKey |
PVTXARQOUXMJEP-UHFFFAOYSA-N |
| Molecular Weight |
384.648 g/mol |
| SMILES |
C12(C(=CCC2C2C=CC3C(C2CC1)(CCC(O)C3)C)C(CCCC(C)C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.948011 |
![8-Hydroxy-3-[[1',5'-dimethyl)hexyl]3a,5b-dimethyl-3a,4,5,5b,6,7,8,9-octahydroindano[6,7-a]naphthalene](/api/spectrum/3BGjS0qZJ2u/structure.png?h=300&w=458 "8-Hydroxy-3-[[1',5'-dimethyl)hexyl]3a,5b-dimethyl-3a,4,5,5b,6,7,8,9-octahydroindano[6,7-a]naphthalene")
