| SpectraBase Spectrum ID |
JNo1iRrBFiF |
| Name |
Dimethyl 2-(4-fluorophenyl)maleate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.064136993 u |
| Formula |
C12H11FO4 |
| InChI |
InChI=1S/C12H11FO4/c1-16-11(14)7-10(12(15)17-2)8-3-5-9(13)6-4-8/h3-7H,1-2H3/b10-7- |
| InChIKey |
ZHVYMALCMDETSX-YFHOEESVSA-N |
| Molecular Weight |
238.214 g/mol |
| SMILES |
C(=O)(OC)\C(=C/C(=O)OC)C1=CC=C(C=C1)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.921454 |
