| SpectraBase Spectrum ID |
2qQsVa90uXM |
| Name |
1H-Isoindole-5-carboxylic acid, 2-(4-fluorophenyl)-2,3-dihydro-1,3-dioxo-, 1-methyl-2-oxo-2-phenylethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
417.101250777 u |
| Formula |
C24H16FNO5 |
| InChI |
InChI=1S/C24H16FNO5/c1-14(21(27)15-5-3-2-4-6-15)31-24(30)16-7-12-19-20(13-16)23(29)26(22(19)28)18-10-8-17(25)9-11-18/h2-14H,1H3 |
| InChIKey |
HJZFBGQUCFIMRM-UHFFFAOYSA-N |
| Molecular Weight |
417.392 g/mol |
| SMILES |
C=1C=CC(C(C(OC(C2=CC=3C(N(C(C3C=C2)=O)C=2C=CC(=CC2)F)=O)=O)C)=O)=CC1 |
