| SpectraBase Compound ID | 4Y8SLZdBgoF |
|---|---|
| InChI | InChI=1S/C8H13Br/c9-8-6-4-2-1-3-5-7-8/h4,6,8H,1-3,5,7H2/b6-4- |
| InChIKey | XOAUXFIKYVGQHT-XQRVVYSFSA-N |
| Mol Weight | 189.1 g/mol |
| Molecular Formula | C8H13Br |
| Exact Mass | 188.020063 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 | 2DCoqgPkHnc |
|---|---|
| Name | 1-Cyclooctene, 3-bromo- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.020063419 u |
| Formula | C8H13Br |
| InChI | InChI=1S/C8H13Br/c9-8-6-4-2-1-3-5-7-8/h4,6,8H,1-3,5,7H2/b6-4- |
| InChIKey | XOAUXFIKYVGQHT-XQRVVYSFSA-N |
| Molecular Weight | 189.096 g/mol |
| SMILES | C1C\C=C/C(CCC1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.849155 |