| SpectraBase Spectrum ID |
AptwjiQ42SI |
| Name |
Biphenyl-2,5-dicarboxylic acid di(prop-2-enyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.120509056 u |
| Formula |
C20H18O4 |
| InChI |
InChI=1S/C20H18O4/c1-3-12-23-19(21)16-10-11-17(20(22)24-13-4-2)18(14-16)15-8-6-5-7-9-15/h3-11,14H,1-2,12-13H2 |
| InChIKey |
WDICTNHYWFXFFQ-UHFFFAOYSA-N |
| Molecular Weight |
322.360 g/mol |
| SMILES |
C=1(C(C(=O)OCC=C)=CC=C(C1)C(=O)OCC=C)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938318 |
