| SpectraBase Spectrum ID |
GWBFCZSzCMe |
| Name |
(E)-2-Fluoro-3-methyl-2-butenedioic acid diethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
204.079787058 u |
| Formula |
C9H13FO4 |
| InChI |
InChI=1S/C9H13FO4/c1-4-13-8(11)6(3)7(10)9(12)14-5-2/h4-5H2,1-3H3/b7-6+ |
| InChIKey |
REMDXJPZTJQKQB-VOTSOKGWSA-N |
| Molecular Weight |
204.197 g/mol |
| SMILES |
C(\C(=C/(C(=O)OCC)C)F)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.971517 |
