SpectraBase Spectrum ID |
8vK7gQoydwh |
Name |
acetamide, N-(4-bromophenyl)-2-[[3-cyano-1,4,5,6-tetrahydro-4-(4-methylphenyl)-6-oxo-2-pyridinyl]thio]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
455.030311004 u |
Formula |
C21H18BrN3O2S |
InChI |
InChI=1S/C21H18BrN3O2S/c1-13-2-4-14(5-3-13)17-10-19(26)25-21(18(17)11-23)28-12-20(27)24-16-8-6-15(22)7-9-16/h2-9,17H,10,12H2,1H3,(H,24,27)(H,25,26) |
InChIKey |
BPANLPHJNWGKTM-UHFFFAOYSA-N |
Molecular Weight |
456.358 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_3045 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9258408; Lab Info: *0866208*; Lab Number: BAS 0866208 |
Temperature |
23.85 °C |