![Bicyclo[2.2.1]heptane-2-ethanol, 3,3-dimethyl-](/api/spectrum/KRB6xFZXOwa/structure.png?h=300&w=458 "Bicyclo[2.2.1]heptane-2-ethanol, 3,3-dimethyl-")
| SpectraBase Compound ID | 9bVTERuJmM |
|---|---|
| InChI | InChI=1S/C11H20O/c1-11(2)9-4-3-8(7-9)10(11)5-6-12/h8-10,12H,3-7H2,1-2H3 |
| InChIKey | DUINBOMGEZFPDK-UHFFFAOYSA-N |
| Mol Weight | 168.28 g/mol |
| Molecular Formula | C11H20O |
| Exact Mass | 168.151415 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | KRB6xFZXOwa |
|---|---|
| Name | Bicyclo[2.2.1]heptane-2-ethanol, 3,3-dimethyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.151415263 u |
| Formula | C11H20O |
| InChI | InChI=1S/C11H20O/c1-11(2)9-4-3-8(7-9)10(11)5-6-12/h8-10,12H,3-7H2,1-2H3 |
| InChIKey | DUINBOMGEZFPDK-UHFFFAOYSA-N |
| Molecular Weight | 168.280 g/mol |
| SMILES | OCCC1C(C2CCC1C2)(C)C |
| Spectrum/Structure Validation Score (Raman) | 0.942321 |