SpectraBase Spectrum ID |
A5pkm7NQt3b |
Name |
4,6(1H,5H)-pyrimidinedione, dihydro-5-[(1-methyl-1H-pyrrol-2-yl)methylene]-1-phenyl-2-thioxo-, (5E)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
311.072847843 u |
Formula |
C16H13N3O2S |
InChI |
InChI=1S/C16H13N3O2S/c1-18-9-5-8-12(18)10-13-14(20)17-16(22)19(15(13)21)11-6-3-2-4-7-11/h2-10H,1H3,(H,17,20,22)/b13-10+ |
InChIKey |
MEGFBASJGORXIQ-JLHYYAGUSA-N |
Molecular Weight |
311.359 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_6468 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9253445; Lab Info: LP; Lab Number: LP-0020056 |