| SpectraBase Compound ID | 9IAjBzlivcC |
|---|---|
| InChI | InChI=1S/C8H9BrO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H,6H2/t8-/m1/s1 |
| InChIKey | DAHHEUQBMDBSLO-MRVPVSSYSA-N |
| Mol Weight | 201.06 g/mol |
| Molecular Formula | C8H9BrO |
| Exact Mass | 199.983678 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | I6ZG6jmXULT |
|---|---|
| Name | (1S)-2-Bromanyl-1-phenyl-ethanol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 199.983677909 u |
| Formula | C8H9BrO |
| InChI | InChI=1S/C8H9BrO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H,6H2/t8-/m1/s1 |
| InChIKey | DAHHEUQBMDBSLO-MRVPVSSYSA-N |
| Molecular Weight | 201.063 g/mol |
| SMILES | [C@](CBr)(C=1C=CC=CC1)(O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.932149 |