SpectraBase Spectrum ID |
HDF2JUUaOUe |
Name |
2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(3-bromo-4-methoxyphenyl)-3,4,7,8-tetrahydro-6-oxo-3-phenyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
455.030311004 u |
Formula |
C21H18BrN3O2S |
InChI |
InChI=1S/C21H18BrN3O2S/c1-27-19-8-7-14(9-18(19)22)16-10-20(26)25-12-24(15-5-3-2-4-6-15)13-28-21(25)17(16)11-23/h2-9,16H,10,12-13H2,1H3 |
InChIKey |
ZAXJPZIQTVJJHO-UHFFFAOYSA-N |
Molecular Weight |
456.358 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_3740 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13278774 |