| SpectraBase Spectrum ID |
6IoQRv1BwZA |
| Name |
2,2-Dimethylpropionic acid, 1-naphthyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
228.115029753 u |
| Formula |
C15H16O2 |
| InChI |
InChI=1S/C15H16O2/c1-15(2,3)14(16)17-13-10-6-8-11-7-4-5-9-12(11)13/h4-10H,1-3H3 |
| InChIKey |
LQSGTVGOLFWRJY-UHFFFAOYSA-N |
| Molecular Weight |
228.291 g/mol |
| SMILES |
CC(C)(C)C(=O)OC1=CC=CC=2C1=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840869 |
