SpectraBase Spectrum ID |
7fxwf9rmbVs |
Name |
2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 8-(3-bromo-5-ethoxy-4-hydroxyphenyl)-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 |
519.001903355 u |
Formula |
C22H19BrClN3O3S |
InChI |
InChI=1S/C22H19BrClN3O3S/c1-2-30-19-7-13(6-18(23)21(19)29)16-9-20(28)27-11-26(12-31-22(27)17(16)10-25)15-5-3-4-14(24)8-15/h3-8,16,29H,2,9,11-12H2,1H3 |
InChIKey |
BTYHTVXYMOXAGI-UHFFFAOYSA-N |
Molecular Weight |
520.829 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_3140 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13278318 |