SpectraBase Spectrum ID |
KXYTInAQB0Y |
Name |
acetamide, N-[5-(4-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-([1,2,4]triazolo[4,3-a]quinolin-1-ylthio)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
452.028079110 u |
Formula |
C20H13ClN6OS2 |
InChI |
InChI=1S/C20H13ClN6OS2/c21-14-8-5-13(6-9-14)18-23-19(26-30-18)22-17(28)11-29-20-25-24-16-10-7-12-3-1-2-4-15(12)27(16)20/h1-10H,11H2,(H,22,26,28) |
InChIKey |
RXBPBKXXYIWVKH-UHFFFAOYSA-N |
Molecular Weight |
452.938 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_1649 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13268005 |