SpectraBase Spectrum ID |
39KwF4BCBAY |
Name |
4-(sec-butylamino)-6-chloro-1,3,5-triazin-2-yl[(1,1-dioxido-3-oxo-1,2-benzisothiazol-2(3H)-yl)methyl]cyanamide |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
421.072386274 u |
Formula |
C16H16ClN7O3S |
InChI |
InChI=1S/C16H16ClN7O3S/c1-3-10(2)19-15-20-14(17)21-16(22-15)23(8-18)9-24-13(25)11-6-4-5-7-12(11)28(24,26)27/h4-7,10H,3,9H2,1-2H3,(H,19,20,21,22) |
InChIKey |
OMGBOSSCVRHNAO-UHFFFAOYSA-N |
Molecular Weight |
421.863 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_3243 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12288680 |