SpectraBase Spectrum ID |
6LECNPrMLkC |
Name |
acetamide, 2-[[3-cyano-1,4,5,6-tetrahydro-4-(2-nitrophenyl)-6-oxo-2-pyridinyl]thio]-N-(4-ethoxyphenyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
452.115440929 u |
Formula |
C22H20N4O5S |
InChI |
InChI=1S/C22H20N4O5S/c1-2-31-15-9-7-14(8-10-15)24-21(28)13-32-22-18(12-23)17(11-20(27)25-22)16-5-3-4-6-19(16)26(29)30/h3-10,17H,2,11,13H2,1H3,(H,24,28)(H,25,27) |
InChIKey |
FMSRKPLTYVRJCI-UHFFFAOYSA-N |
Molecular Weight |
452.485 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6621 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9264798; Lab Info: KR; Lab Number: KR-0000035 |