| SpectraBase Spectrum ID |
Gh4Gsvav4bl |
| Name |
Biphenyl-2,4'-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/c1-3-13-23-19(21)16-11-9-15(10-12-16)17-7-5-6-8-18(17)20(22)24-14-4-2/h3-12H,1-2,13-14H2 |
| InChIKey |
PQRGADXHQWHWEJ-UHFFFAOYSA-N |
| Molecular Weight |
322.360 g/mol |
| SMILES |
C=1(C(C=2C=CC(C(=O)OCC=C)=CC2)=CC=CC1)C(=O)OCC=C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854422 |
