SpectraBase Spectrum ID |
CtdzgAIVjC5 |
Name |
benzoic acid, 3-[4-(4-chlorophenyl)-1,2,3,4,5,7-hexahydro-1-methyl-2,5-dioxo-6H-pyrrolo[3,4-d]pyrimidin-6-yl]- |
Author |
A.V.Yarkov, IPAC, Russia |
Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
InChI |
InChI=1S/C20H16ClN3O4/c1-23-15-10-24(14-4-2-3-12(9-14)19(26)27)18(25)16(15)17(22-20(23)28)11-5-7-13(21)8-6-11/h2-9,17H,10H2,1H3,(H,22,28)(H,26,27) |
InChIKey |
TZXVCNGXOULRID-UHFFFAOYSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_ASIOH_7529_7089 |
Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
Sample State |
soluted |
Solvent |
DMSO-d6 |
Source File Reference |
VendorID: NMR/18277238; Labnumber: POV-2200303 |