| SpectraBase Spectrum ID |
tAWJ7S2sde |
| Name |
Phenylacetic acid, 2-naphthyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
262.099379689 u |
| Formula |
C18H14O2 |
| InChI |
InChI=1S/C18H14O2/c19-18(12-14-6-2-1-3-7-14)20-17-11-10-15-8-4-5-9-16(15)13-17/h1-11,13H,12H2 |
| InChIKey |
GOALADUJAUGWAQ-UHFFFAOYSA-N |
| Molecular Weight |
262.308 g/mol |
| SMILES |
C1=CC=CC=C1CC(OC1=CC=C2C=CC=CC2=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.827016 |
