SpectraBase Spectrum ID |
EtdTNS67T4g |
Name |
5(4H)-oxazolone, 4-[[2-[(4-chlorophenyl)thio]-8-methyl-3-quinolinyl]methylene]-2-(3,4,5-trimethoxyphenyl)-, (4E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
546.101620718 u |
Formula |
C29H23ClN2O5S |
InChI |
InChI=1S/C29H23ClN2O5S/c1-16-6-5-7-17-12-19(28(32-25(16)17)38-21-10-8-20(30)9-11-21)13-22-29(33)37-27(31-22)18-14-23(34-2)26(36-4)24(15-18)35-3/h5-15H,1-4H3/b22-13+ |
InChIKey |
YOGAOEBOEWLLRV-LPYMAVHISA-N |
Molecular Weight |
547.025 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_2452 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13268802 |