| SpectraBase Spectrum ID |
GOI2FcpVmXO |
| Name |
1-Naphthalenecarboxylic acid, phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
248.083729624 u |
| Formula |
C17H12O2 |
| InChI |
InChI=1S/C17H12O2/c18-17(19-14-9-2-1-3-10-14)16-12-6-8-13-7-4-5-11-15(13)16/h1-12H |
| InChIKey |
IGJYWORNVRWOKZ-UHFFFAOYSA-N |
| Molecular Weight |
248.281 g/mol |
| SMILES |
C(C1=C2C(C=CC=C2)=CC=C1)(OC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818395 |
