| SpectraBase Compound ID | 2Ag9MUyfBEp |
|---|---|
| InChI | InChI=1S/C5H9BrO/c6-3-5(7)4-1-2-4/h4-5,7H,1-3H2 |
| InChIKey | YOMSZYTYIYJBSC-UHFFFAOYSA-N |
| Mol Weight | 165.03 g/mol |
| Molecular Formula | C5H9BrO |
| Exact Mass | 163.983678 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HKxbrYR3vvI |
|---|---|
| Name | 2-Bromo-1-cyclopropylethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 163.983677909 u |
| Formula | C5H9BrO |
| InChI | InChI=1S/C5H9BrO/c6-3-5(7)4-1-2-4/h4-5,7H,1-3H2 |
| InChIKey | YOMSZYTYIYJBSC-UHFFFAOYSA-N |
| Molecular Weight | 165.030 g/mol |
| SMILES | C1C(C(CBr)O)C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.87591 |