| SpectraBase Spectrum ID |
1MI0h0XmtfZ |
| Name |
2-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-3-(1H-indol-3-yl)-propionic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
334.095356935 u |
| Formula |
C19H14N2O4 |
| InChI |
InChI=1S/C19H14N2O4/c22-17-13-6-1-2-7-14(13)18(23)21(17)16(19(24)25)9-11-10-20-15-8-4-3-5-12(11)15/h1-8,10,16,20H,9H2,(H,24,25) |
| InChIKey |
HPTXLHAHLXOAKV-UHFFFAOYSA-N |
| Molecular Weight |
334.331 g/mol |
| SMILES |
C1(N(C(C2=CC=CC=C12)=O)C(CC1=CNC2=C1C=CC=C2)C(=O)O)=O |
