| SpectraBase Spectrum ID |
GwqoaBpsXl1 |
| Name |
Bicyclo[3.3.1]nonan-3-one, 7-(7-hydroxyheptyl)-, exo- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
252.208930140 u |
| Formula |
C16H28O2 |
| InChI |
InChI=1S/C16H28O2/c17-7-5-3-1-2-4-6-13-8-14-10-15(9-13)12-16(18)11-14/h13-15,17H,1-12H2 |
| InChIKey |
UVKTUCGRJBNOQZ-UHFFFAOYSA-N |
| Molecular Weight |
252.398 g/mol |
| SMILES |
C1(=O)CC2CC(CC(C1)C2)CCCCCCCO |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.849677 |
![Bicyclo[3.3.1]nonan-3-one, 7-(7-hydroxyheptyl)-, exo-](/api/spectrum/GwqoaBpsXl1/structure.png?h=300&w=458 "Bicyclo[3.3.1]nonan-3-one, 7-(7-hydroxyheptyl)-, exo-")
