| SpectraBase Spectrum ID |
HeAU3QZuuJh |
| Name |
(5E)-1-(4-bromophenyl)-5-[3-ethoxy-4-(2-propynyloxy)benzylidene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
484.009241205 u |
| Formula |
C22H17BrN2O4S |
| InChI |
InChI=1S/C22H17BrN2O4S/c1-3-11-29-18-10-5-14(13-19(18)28-4-2)12-17-20(26)24-22(30)25(21(17)27)16-8-6-15(23)7-9-16/h1,5-10,12-13H,4,11H2,2H3,(H,24,26,30)/b17-12+ |
| InChIKey |
CXAIFROOBQHIGX-SFQUDFHCSA-N |
| Molecular Weight |
485.352 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_5342 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12318746 |
![(5E)-1-(4-bromophenyl)-5-[3-ethoxy-4-(2-propynyloxy)benzylidene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione](/api/spectrum/HeAU3QZuuJh/structure.png?h=300&w=458 "(5E)-1-(4-bromophenyl)-5-[3-ethoxy-4-(2-propynyloxy)benzylidene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione")
