SpectraBase Spectrum ID |
6SfE0Bs3tUY |
Name |
acetamide, 2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-methoxyphenyl)-6-oxo-2-pyridinyl]thio]-N-(4-iodophenyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
519.011357623 u |
Formula |
C21H18IN3O3S |
InChI |
InChI=1S/C21H18IN3O3S/c1-28-16-8-2-13(3-9-16)17-10-19(26)25-21(18(17)11-23)29-12-20(27)24-15-6-4-14(22)5-7-15/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26) |
InChIKey |
SOZCAVQSQPFFOL-UHFFFAOYSA-N |
Molecular Weight |
519.357 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_10512 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10251761; Lab Info: KR; Lab Number: KR-KK00017 |