| SpectraBase Spectrum ID |
J4fUeWHFud0 |
| Name |
3-(4-chlorophenyl)-1-(4-methylbenzyl)-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
450.116876861 u |
| Formula |
C25H23ClN2O2S |
| InChI |
InChI=1S/C25H23ClN2O2S/c1-16-7-9-17(10-8-16)15-27-24-22(20-5-3-2-4-6-21(20)31-24)23(29)28(25(27)30)19-13-11-18(26)12-14-19/h7-14H,2-6,15H2,1H3 |
| InChIKey |
HHANNICYXLQBIF-UHFFFAOYSA-N |
| Molecular Weight |
450.984 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2020_6377 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/12328544 |
![3-(4-chlorophenyl)-1-(4-methylbenzyl)-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione](/api/spectrum/J4fUeWHFud0/structure.png?h=300&w=458 "3-(4-chlorophenyl)-1-(4-methylbenzyl)-1,5,6,7,8,9-hexahydro-2H-cyclohepta[4,5]thieno[2,3-d]pyrimidine-2,4(3H)-dione")
