SpectraBase Spectrum ID |
ETLle9RbNku |
Name |
5-{[4-(5-chloro-2-methylphenyl)-1-piperazinyl]sulfonyl}-6-methyl-2,4(1H,3H)-pyrimidinedione |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
398.081553978 u |
Formula |
C16H19ClN4O4S |
InChI |
InChI=1S/C16H19ClN4O4S/c1-10-3-4-12(17)9-13(10)20-5-7-21(8-6-20)26(24,25)14-11(2)18-16(23)19-15(14)22/h3-4,9H,5-8H2,1-2H3,(H2,18,19,22,23) |
InChIKey |
KXQMKHZXFUPISW-UHFFFAOYSA-N |
Molecular Weight |
398.865 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_710 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12268697 |