| SpectraBase Compound ID | FYGaYL8nlGJ |
|---|---|
| InChI | InChI=1S/C14H9NO2/c15-10-17-13-9-5-4-8-12(13)14(16)11-6-2-1-3-7-11/h1-9H |
| InChIKey | QEFZVRHMYRJDNO-UHFFFAOYSA-N |
| Mol Weight | 223.23 g/mol |
| Molecular Formula | C14H9NO2 |
| Exact Mass | 223.063329 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EnkzT61PViI |
|---|---|
| Name | 2-Cyanato-benzophenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 223.063328532 u |
| Formula | C14H9NO2 |
| InChI | InChI=1S/C14H9NO2/c15-10-17-13-9-5-4-8-12(13)14(16)11-6-2-1-3-7-11/h1-9H |
| InChIKey | QEFZVRHMYRJDNO-UHFFFAOYSA-N |
| Molecular Weight | 223.231 g/mol |
| SMILES | C(C=1C(=CC=CC1)OC#N)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.977147 |