| SpectraBase Spectrum ID |
BGlXUI3E3bw |
| Name |
Succinic acid, 4-biphenyl ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.120509056 u |
| Formula |
C18H18O4 |
| InChI |
InChI=1S/C18H18O4/c1-2-21-17(19)12-13-18(20)22-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11H,2,12-13H2,1H3 |
| InChIKey |
NNFIVIKVPQPNJO-UHFFFAOYSA-N |
| SMILES |
C(C(OC1=CC=C(C2=CC=CC=C2)C=C1)=O)CC(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.890705 |
