SpectraBase Spectrum ID |
3iVVtZTPl82 |
Name |
Butyric acid, 2-phenyl-, naphth-2-ylmethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
304.146329882 u |
Formula |
C21H20O2 |
InChI |
InChI=1S/C21H20O2/c1-2-20(18-9-4-3-5-10-18)21(22)23-15-16-12-13-17-8-6-7-11-19(17)14-16/h3-14,20H,2,15H2,1H3 |
InChIKey |
REMBVPSKNNWYIO-UHFFFAOYSA-N |
Molecular Weight |
304.389 g/mol |
SMILES |
C(C(C(OCC1=CC2=C(C=CC=C2)C=C1)=O)C1=CC=CC=C1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879203 |