| SpectraBase Spectrum ID |
4TmUHNtUAYF |
| Name |
1H-isoindole-5-carboxylic acid, 2-[4-(4-cyanophenoxy)phenyl]-2,3-dihydro-1,3-dioxo-, 2-(4-chlorophenyl)-2-oxoethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
536.077513969 u |
| Formula |
C30H17ClN2O6 |
| InChI |
InChI=1S/C30H17ClN2O6/c31-21-6-3-19(4-7-21)27(34)17-38-30(37)20-5-14-25-26(15-20)29(36)33(28(25)35)22-8-12-24(13-9-22)39-23-10-1-18(16-32)2-11-23/h1-15H,17H2 |
| InChIKey |
FESFAQWBGVLJKJ-UHFFFAOYSA-N |
| Molecular Weight |
536.927 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_1827 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8158246; Lab Info: AI; Lab Number: AI-1410643 |
| Temperature |
29.85 °C |
![1H-isoindole-5-carboxylic acid, 2-[4-(4-cyanophenoxy)phenyl]-2,3-dihydro-1,3-dioxo-, 2-(4-chlorophenyl)-2-oxoethyl ester](/api/spectrum/4TmUHNtUAYF/structure.png?h=300&w=458 "1H-isoindole-5-carboxylic acid, 2-[4-(4-cyanophenoxy)phenyl]-2,3-dihydro-1,3-dioxo-, 2-(4-chlorophenyl)-2-oxoethyl ester")
