| SpectraBase Spectrum ID |
401pEVFNRch |
| Name |
benzoic acid, 4-[5-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl]-, ethyl ester |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
486.142701049 u |
| Formula |
C27H22N2O7 |
| InChI |
InChI=1S/C27H22N2O7/c1-3-35-26(33)16-5-10-19(11-6-16)28-23(30)18-9-14-21-22(15-18)25(32)29(24(21)31)20-12-7-17(8-13-20)27(34)36-4-2/h5-15H,3-4H2,1-2H3,(H,28,30) |
| InChIKey |
BKMRVMYJPXUYJT-UHFFFAOYSA-N |
| Molecular Weight |
486.480 g/mol |
| NMR Offset |
17.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_5718 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9244746; Lab Info: AI; Lab Number: AI-S000536 |
![benzoic acid, 4-[5-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl]-, ethyl ester](/api/spectrum/401pEVFNRch/structure.png?h=300&w=458 "benzoic acid, 4-[5-[[[4-(ethoxycarbonyl)phenyl]amino]carbonyl]-1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl]-, ethyl ester")
