| SpectraBase Spectrum ID |
1uZYo7fkjqZ |
| Name |
1H-Isoindole-5-carboxylic acid, 2,3-dihydro-1,3-dioxo-2-(4-phenoxyphenyl)-, 2-oxo-2-phenylethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
477.121237330 u |
| Formula |
C29H19NO6 |
| InChI |
InChI=1S/C29H19NO6/c31-26(19-7-3-1-4-8-19)18-35-29(34)20-11-16-24-25(17-20)28(33)30(27(24)32)21-12-14-23(15-13-21)36-22-9-5-2-6-10-22/h1-17H,18H2 |
| InChIKey |
QXGIFZICIGMLJG-UHFFFAOYSA-N |
| Molecular Weight |
477.472 g/mol |
| SMILES |
C=1C=CC(OC=2C=CC(N3C(C4=CC(C(OCC(=O)C5=CC=CC=C5)=O)=CC=C4C3=O)=O)=CC2)=CC1 |
