| SpectraBase Compound ID | BaT50uJ4uzw |
|---|---|
| InChI | InChI=1S/C7H12N2/c1-6(5-8)9-7(2,3)4/h9H,1H2,2-4H3 |
| InChIKey | LDAMPPJUIQRHGH-UHFFFAOYSA-N |
| Mol Weight | 124.19 g/mol |
| Molecular Formula | C7H12N2 |
| Exact Mass | 124.100048 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 | Llk3pCL3joX |
|---|---|
| Name | 2-T-Butylaminoacrylonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 124.100048394 u |
| Formula | C7H12N2 |
| InChI | InChI=1S/C7H12N2/c1-6(5-8)9-7(2,3)4/h9H,1H2,2-4H3 |
| InChIKey | LDAMPPJUIQRHGH-UHFFFAOYSA-N |
| Molecular Weight | 124.187 g/mol |
| SMILES | CC(C)(NC(C#N)=C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.815331 |