| SpectraBase Spectrum ID |
Hm2413APMMp |
| Name |
Succinic acid, 5-fluoro-2-nitrophenyl 3,4-dimethylphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.096165396 u |
| Formula |
C18H16FNO6 |
| InChI |
InChI=1S/C18H16FNO6/c1-11-3-5-14(9-12(11)2)25-17(21)7-8-18(22)26-16-10-13(19)4-6-15(16)20(23)24/h3-6,9-10H,7-8H2,1-2H3 |
| InChIKey |
DIOWEZOGKNUBOZ-UHFFFAOYSA-N |
| Molecular Weight |
361.325 g/mol |
| SMILES |
CC1=CC=C(C=C1C)OC(CCC(OC1=C(C=CC(=C1)F)N(=O)=O)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946935 |
