SpectraBase Spectrum ID |
B9LTS6mbQGF |
Name |
4H-imidazol-4-one, 3-(3-chloro-4-methoxyphenyl)-3,5-dihydro-5-[(4-methylphenyl)methylene]-2-(propylthio)-, (5Z)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
400.101226796 u |
Formula |
C21H21ClN2O2S |
InChI |
InChI=1S/C21H21ClN2O2S/c1-4-11-27-21-23-18(12-15-7-5-14(2)6-8-15)20(25)24(21)16-9-10-19(26-3)17(22)13-16/h5-10,12-13H,4,11H2,1-3H3/b18-12- |
InChIKey |
KKBQNGLAIKTPJD-PDGQHHTCSA-N |
Molecular Weight |
400.924 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4870 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13288675 |