SpectraBase Spectrum ID |
IaeYr8Z1YmY |
Name |
pyrimido[4,5-b]quinoline-4,6(3H,7H)-dione, 5-(4-chlorophenyl)-5,8,9,10-tetrahydro-8,8-dimethyl-2-[[2-(4-morpholinyl)ethyl]thio]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
500.164889681 u |
Formula |
C25H29ClN4O3S |
InChI |
InChI=1S/C25H29ClN4O3S/c1-25(2)13-17-20(18(31)14-25)19(15-3-5-16(26)6-4-15)21-22(27-17)28-24(29-23(21)32)34-12-9-30-7-10-33-11-8-30/h3-6,19H,7-14H2,1-2H3,(H2,27,28,29,32) |
InChIKey |
ILTATAJUTJYZHB-UHFFFAOYSA-N |
Molecular Weight |
501.045 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_869 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13239352 |