| SpectraBase Spectrum ID |
I2sJU3ioxDm |
| Name |
Bicyclo[3.2.1]octan-6-one, 5-hydroxy-2-(1-methylethyl)-, endo-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
182.130679818 u |
| Formula |
C11H18O2 |
| InChI |
InChI=1S/C11H18O2/c1-7(2)9-3-4-11(13)6-8(9)5-10(11)12/h7-9,13H,3-6H2,1-2H3 |
| InChIKey |
XJRSUTFFUDZOGW-UHFFFAOYSA-N |
| Molecular Weight |
182.263 g/mol |
| SMILES |
C12(C(CC(C2)C(CC1)C(C)C)=O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900904 |
![Bicyclo[3.2.1]octan-6-one, 5-hydroxy-2-(1-methylethyl)-, endo-(.+-.)-](/api/spectrum/I2sJU3ioxDm/structure.png?h=300&w=458 "Bicyclo[3.2.1]octan-6-one, 5-hydroxy-2-(1-methylethyl)-, endo-(.+-.)-")
