SpectraBase Spectrum ID |
ACeJXT4qEr1 |
Name |
3-butyl-2-[(2-oxo-2-phenylethyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
408.096620238 u |
Formula |
C22H20N2O2S2 |
InChI |
InChI=1S/C22H20N2O2S2/c1-2-3-13-24-21(26)20-19(16-11-7-8-12-18(16)28-20)23-22(24)27-14-17(25)15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3 |
InChIKey |
QYALOPHFNGWZAY-UHFFFAOYSA-N |
Molecular Weight |
408.534 g/mol |
NMR Offset |
17.9986 |
NMR Spectrometer Frequency |
500.136 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_9849 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13229922 |