SpectraBase Spectrum ID |
FTsnaYaLRNw |
Name |
benzoic acid, 4-(4,6-dihydro-4-(4-hydroxy-3-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 |
475.120191957 u |
Formula |
C25H21N3O5S |
InChI |
InChI=1S/C25H21N3O5S/c1-3-33-25(31)14-6-9-16(10-7-14)28-23(15-8-11-17(29)18(13-15)32-2)20-21(19-5-4-12-34-19)26-27-22(20)24(28)30/h4-13,23,29H,3H2,1-2H3,(H,26,27) |
InChIKey |
UGNPGLJGCKPZTB-UHFFFAOYSA-N |
Molecular Weight |
475.519 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_7417 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13308197 |