| SpectraBase Spectrum ID |
1PkASYkBYrN |
| Name |
benzoic acid, 4-(5-bromo-1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)-,propyl 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 |
437.026270995 u |
| Formula |
C22H16BrNO4 |
| InChI |
InChI=1S/C22H16BrNO4/c1-2-10-28-22(27)13-6-8-16(9-7-13)24-20(25)17-5-3-4-14-11-15(23)12-18(19(14)17)21(24)26/h3-9,11-12H,2,10H2,1H3 |
| InChIKey |
MGEHYEOHNXORDJ-UHFFFAOYSA-N |
| Molecular Weight |
438.277 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_3410 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9278286; Lab Number: BAS 0834164 |
| Temperature |
29.85 °C |
![benzoic acid, 4-(5-bromo-1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)-,propyl ester](/api/spectrum/1PkASYkBYrN/structure.png?h=300&w=458 "benzoic acid, 4-(5-bromo-1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)-,propyl ester")
