| SpectraBase Compound ID | 2IOs6QksWAs |
|---|---|
| InChI | InChI=1S/C7H10BrN/c8-6-4-2-1-3-5-7-9/h3,5H,1-2,4,6H2/b5-3+ |
| InChIKey | PNCOXIWMUFFVNK-HWKANZROSA-N |
| Mol Weight | 188.07 g/mol |
| Molecular Formula | C7H10BrN |
| Exact Mass | 186.999662 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 | FYkeJ761ssO |
|---|---|
| Name | 7-Bromo-2-heptenenitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 186.999662326 u |
| Formula | C7H10BrN |
| InChI | InChI=1S/C7H10BrN/c8-6-4-2-1-3-5-7-9/h3,5H,1-2,4,6H2/b5-3+ |
| InChIKey | PNCOXIWMUFFVNK-HWKANZROSA-N |
| Molecular Weight | 188.068 g/mol |
| SMILES | C(#N)\C=C\CCCCBr |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.924779 |