| SpectraBase Compound ID | CvpsIEQDk67 |
|---|---|
| InChI | InChI=1S/C10H19BrO/c1-7-4-5-8(6-9(7)12)10(2,3)11/h7-9,12H,4-6H2,1-3H3 |
| InChIKey | QTBHCAAOJIAJME-UHFFFAOYSA-N |
| Mol Weight | 235.16 g/mol |
| Molecular Formula | C10H19BrO |
| Exact Mass | 234.061928 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 12WbCb6G6bN |
|---|---|
| Name | 5-(1-Bromo-1-methyl-ethyl)-2-methyl-cyclohexanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 234.061928231 u |
| Formula | C10H19BrO |
| InChI | InChI=1S/C10H19BrO/c1-7-4-5-8(6-9(7)12)10(2,3)11/h7-9,12H,4-6H2,1-3H3 |
| InChIKey | QTBHCAAOJIAJME-UHFFFAOYSA-N |
| Molecular Weight | 235.165 g/mol |
| SMILES | C(Br)(C)(C)C1CC(O)C(CC1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.887428 |