SpectraBase Spectrum ID |
FYbixaKI092 |
Name |
acetamide, 2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-methoxyphenyl)-6-oxo-2-pyridinyl]thio]-N-(3,5-dichlorophenyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
461.036767990 u |
Formula |
C21H17Cl2N3O3S |
InChI |
InChI=1S/C21H17Cl2N3O3S/c1-29-16-4-2-12(3-5-16)17-9-19(27)26-21(18(17)10-24)30-11-20(28)25-15-7-13(22)6-14(23)8-15/h2-8,17H,9,11H2,1H3,(H,25,28)(H,26,27) |
InChIKey |
SCPIFIRDAUNNGN-UHFFFAOYSA-N |
Molecular Weight |
462.351 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_10511 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10251760; Lab Info: KR; Lab Number: KR-KK00016 |