| SpectraBase Compound ID | Logwa3qxdFZ |
|---|---|
| InChI | InChI=1S/C9H9NO/c11-8-4-7-10-9-5-2-1-3-6-9/h1-8,10H/b7-4+ |
| InChIKey | QVWWPUHSJYHELM-QPJJXVBHSA-N |
| Mol Weight | 147.18 g/mol |
| Molecular Formula | C9H9NO |
| Exact Mass | 147.068414 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HCjuEDspNWP |
|---|---|
| Name | 2-Propenal, 3-phenylamino- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 147.068413913 u |
| Formula | C9H9NO |
| InChI | InChI=1S/C9H9NO/c11-8-4-7-10-9-5-2-1-3-6-9/h1-8,10H/b7-4+ |
| InChIKey | QVWWPUHSJYHELM-QPJJXVBHSA-N |
| Molecular Weight | 147.177 g/mol |
| SMILES | C1(N\C=C\C=O)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955319 |