| SpectraBase Compound ID | 2ioQW6KQuwZ |
|---|---|
| InChI | InChI=1S/C19H16O2/c20-19(17-8-2-1-3-9-17)21-14-13-16-11-6-10-15-7-4-5-12-18(15)16/h1-12H,13-14H2 |
| InChIKey | YHPGVSRYDNTKTJ-UHFFFAOYSA-N |
| Mol Weight | 276.33 g/mol |
| Molecular Formula | C19H16O2 |
| Exact Mass | 276.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5zBcNU0KEQc |
|---|---|
| Name | 2-(1-Naphthyl)ethyl benzoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 276.115029753 u |
| Formula | C19H16O2 |
| InChI | InChI=1S/C19H16O2/c20-19(17-8-2-1-3-9-17)21-14-13-16-11-6-10-15-7-4-5-12-18(15)16/h1-12H,13-14H2 |
| InChIKey | YHPGVSRYDNTKTJ-UHFFFAOYSA-N |
| SMILES | C(C=1C=CC=CC1)(=O)OCCC=1C=CC=C2C=CC=CC12 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.850483 |