| SpectraBase Spectrum ID |
28SXDvG4ISh |
| Name |
3-butyl-2-[(2-chlorobenzyl)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 |
414.062733287 u |
| Formula |
C21H19ClN2OS2 |
| InChI |
InChI=1S/C21H19ClN2OS2/c1-2-3-12-24-20(25)19-18(15-9-5-7-11-17(15)27-19)23-21(24)26-13-14-8-4-6-10-16(14)22/h4-11H,2-3,12-13H2,1H3 |
| InChIKey |
PJRPPORXKOVGJY-UHFFFAOYSA-N |
| Molecular Weight |
414.969 g/mol |
| NMR Offset |
17.9984 |
| NMR Spectrometer Frequency |
500.136 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_9855 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13229928 |
![3-butyl-2-[(2-chlorobenzyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one](/api/spectrum/28SXDvG4ISh/structure.png?h=300&w=458 "3-butyl-2-[(2-chlorobenzyl)sulfanyl][1]benzothieno[3,2-d]pyrimidin-4(3H)-one")
