![2-{[N-(t-Butyl)amino]methyl}-but-2-enenitrile](/api/spectrum/Jg7S7mZEBUK/structure.png?h=300&w=458 "2-{[N-(t-Butyl)amino]methyl}-but-2-enenitrile")
| SpectraBase Compound ID | IpufojrzOgP |
|---|---|
| InChI | InChI=1S/C9H16N2/c1-5-8(6-10)7-11-9(2,3)4/h5,11H,7H2,1-4H3/b8-5+ |
| InChIKey | YXAOIVLODKYPGL-VMPITWQZSA-N |
| Mol Weight | 152.24 g/mol |
| Molecular Formula | C9H16N2 |
| Exact Mass | 152.131349 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Jg7S7mZEBUK |
|---|---|
| Name | 2-{[N-(T-Butyl)amino]methyl}-but-2-enenitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.131348523 u |
| Formula | C9H16N2 |
| InChI | InChI=1S/C9H16N2/c1-5-8(6-10)7-11-9(2,3)4/h5,11H,7H2,1-4H3/b8-5+ |
| InChIKey | YXAOIVLODKYPGL-VMPITWQZSA-N |
| Molecular Weight | 152.241 g/mol |
| SMILES | C(#N)\C(=C/C)CNC(C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.878582 |