| SpectraBase Spectrum ID |
2CEspd52Gku |
| Name |
pyrimido[4,5-b]quinoline-4,6(3H,7H)-dione, 5,8,9,10-tetrahydro-8,8-dimethyl-2-[[2-(4-morpholinyl)ethyl]thio]-5-(4-nitrophenyl)- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
511.188940223 u |
| Formula |
C25H29N5O5S |
| InChI |
InChI=1S/C25H29N5O5S/c1-25(2)13-17-20(18(31)14-25)19(15-3-5-16(6-4-15)30(33)34)21-22(26-17)27-24(28-23(21)32)36-12-9-29-7-10-35-11-8-29/h3-6,19H,7-14H2,1-2H3,(H2,26,27,28,32) |
| InChIKey |
XGPQYBKGBVFCTO-UHFFFAOYSA-N |
| Molecular Weight |
511.597 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_868 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13239351 |
![pyrimido[4,5-b]quinoline-4,6(3H,7H)-dione, 5,8,9,10-tetrahydro-8,8-dimethyl-2-[[2-(4-morpholinyl)ethyl]thio]-5-(4-nitrophenyl)-](/api/spectrum/2CEspd52Gku/structure.png?h=300&w=458 "pyrimido[4,5-b]quinoline-4,6(3H,7H)-dione, 5,8,9,10-tetrahydro-8,8-dimethyl-2-[[2-(4-morpholinyl)ethyl]thio]-5-(4-nitrophenyl)-")
