| SpectraBase Compound ID | 5Wdy8HsMEOz |
|---|---|
| InChI | InChI=1S/C10H11N3/c11-7-6-10(12)13-8-9-4-2-1-3-5-9/h1-6,13H,8,12H2/b10-6+ |
| InChIKey | GMJZDHZTDONJEJ-UXBLZVDNSA-N |
| Mol Weight | 173.22 g/mol |
| Molecular Formula | C10H11N3 |
| Exact Mass | 173.095297 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FJHpHAHLDQN |
|---|---|
| Name | 3-Amino-3-(benzylamino)acrylonitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 173.095297366 u |
| Formula | C10H11N3 |
| InChI | InChI=1S/C10H11N3/c11-7-6-10(12)13-8-9-4-2-1-3-5-9/h1-6,13H,8,12H2/b10-6+ |
| InChIKey | GMJZDHZTDONJEJ-UXBLZVDNSA-N |
| Molecular Weight | 173.219 g/mol |
| SMILES | C(N\C(=C\C#N)N)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.938698 |