SpectraBase Spectrum ID |
K4pqqJNBkDm |
Name |
2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(3-bromo-4-methoxyphenyl)-3-(3-chlorophenyl)-3,4,7,8-tetrahydro-6-oxo- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
488.991338671 u |
Formula |
C21H17BrClN3O2S |
InChI |
InChI=1S/C21H17BrClN3O2S/c1-28-19-6-5-13(7-18(19)22)16-9-20(27)26-11-25(12-29-21(26)17(16)10-24)15-4-2-3-14(23)8-15/h2-8,16H,9,11-12H2,1H3 |
InChIKey |
NYPACOSEPCYIFZ-UHFFFAOYSA-N |
Molecular Weight |
490.803 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_3730 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13278764 |