| SpectraBase Spectrum ID |
A7M56YAPy44 |
| Name |
benzoic acid, 4-(4,6-dihydro-4-(4-methoxyphenyl)-6-oxo-3-(2-thienyl)pyrrolo[3,4-c]pyrazol-5(1H)-yl)-, ethyl 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 |
459.125277338 u |
| Formula |
C25H21N3O4S |
| InChI |
InChI=1S/C25H21N3O4S/c1-3-32-25(30)16-6-10-17(11-7-16)28-23(15-8-12-18(31-2)13-9-15)20-21(19-5-4-14-33-19)26-27-22(20)24(28)29/h4-14,23H,3H2,1-2H3,(H,26,27) |
| InChIKey |
XZSHBRYBQFQNKR-UHFFFAOYSA-N |
| Molecular Weight |
459.520 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_7406 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13308182 |
![benzoic acid, 4-(4,6-dihydro-4-(4-methoxyphenyl)-6-oxo-3-(2-thienyl)pyrrolo[3,4-c]pyrazol-5(1H)-yl)-, ethyl ester](/api/spectrum/A7M56YAPy44/structure.png?h=300&w=458 "benzoic acid, 4-(4,6-dihydro-4-(4-methoxyphenyl)-6-oxo-3-(2-thienyl)pyrrolo[3,4-c]pyrazol-5(1H)-yl)-, ethyl ester")
