| SpectraBase Spectrum ID |
KQadwxBEh3U |
| Name |
3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-3-(4-fluoro-phenyl)-propionic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.075036029 u |
| Formula |
C17H12FNO4 |
| InChI |
InChI=1S/C17H12FNO4/c18-11-7-5-10(6-8-11)14(9-15(20)21)19-16(22)12-3-1-2-4-13(12)17(19)23/h1-8,14H,9H2,(H,20,21) |
| InChIKey |
QRILPICDYUIUCJ-UHFFFAOYSA-N |
| Molecular Weight |
313.284 g/mol |
| SMILES |
C1(N(C(C2=CC=CC=C12)=O)C(CC(=O)O)C1=CC=C(C=C1)F)=O |
