| SpectraBase Compound ID | yxlBofML7o |
|---|---|
| InChI | InChI=1S/C16H13NO/c18-16-11-10-14-8-4-5-9-15(14)17(16)12-13-6-2-1-3-7-13/h1-11H,12H2 |
| InChIKey | OKZVGSVWYGCZBL-UHFFFAOYSA-N |
| Mol Weight | 235.29 g/mol |
| Molecular Formula | C16H13NO |
| Exact Mass | 235.099714 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8XXWzPkBJrK |
|---|---|
| Name | 1-Benzyl-2-quinolone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.099714042 u |
| Formula | C16H13NO |
| InChI | InChI=1S/C16H13NO/c18-16-11-10-14-8-4-5-9-15(14)17(16)12-13-6-2-1-3-7-13/h1-11H,12H2 |
| InChIKey | OKZVGSVWYGCZBL-UHFFFAOYSA-N |
| Molecular Weight | 235.286 g/mol |
| SMILES | C12=C(C=CC=C2)N(C(C=C1)=O)CC1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.852282 |