SpectraBase Spectrum ID |
98mgCjtRlwP |
Name |
1H-purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-[[1-[2-(4-morpholinyl)-2-oxoethyl]-1H-benzimidazol-2-yl]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 |
469.153223419 u |
Formula |
C21H23N7O4S |
InChI |
InChI=1S/C21H23N7O4S/c1-24-16-17(25(2)21(31)26(3)18(16)30)23-19(24)33-20-22-13-6-4-5-7-14(13)28(20)12-15(29)27-8-10-32-11-9-27/h4-7H,8-12H2,1-3H3 |
InChIKey |
SOJGVZBBNNGDOX-UHFFFAOYSA-N |
Molecular Weight |
469.520 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_8328 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9321745; Lab Info: LP; Lab Number: LP-3701118 |