SpectraBase Spectrum ID |
Ac9CiCOsiiF |
Name |
4-[(1-[2-(3-chloroanilino)-2-oxoethyl]-2,4-dioxo-1,4-dihydro-3(2H)-quinazolinyl)methyl]-N-(2-chlorobenzyl)benzamide |
Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
586.117460665 u |
Formula |
C31H24Cl2N4O4 |
InChI |
InChI=1S/C31H24Cl2N4O4/c32-23-7-5-8-24(16-23)35-28(38)19-36-27-11-4-2-9-25(27)30(40)37(31(36)41)18-20-12-14-21(15-13-20)29(39)34-17-22-6-1-3-10-26(22)33/h1-16H,17-19H2,(H,34,39)(H,35,38) |
InChIKey |
PDUNLERSLBSJDO-UHFFFAOYSA-N |
Molecular Weight |
587.463 g/mol |
NMR Offset |
17.9982 |
NMR Spectrometer Frequency |
500.136 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_9572 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13229485 |