SpectraBase Spectrum ID |
I3B2CXZ07by |
Name |
1H-purine-2,6-dione, 3,7-dihydro-1,3,7-trimethyl-8-[[2-[5-methyl-2-(1-methylethyl)phenoxy]ethyl]amino]- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
385.211389746 u |
Formula |
C20H27N5O3 |
InChI |
InChI=1S/C20H27N5O3/c1-12(2)14-8-7-13(3)11-15(14)28-10-9-21-19-22-17-16(23(19)4)18(26)25(6)20(27)24(17)5/h7-8,11-12H,9-10H2,1-6H3,(H,21,22) |
InChIKey |
VECQKJYWXFSGIZ-UHFFFAOYSA-N |
Molecular Weight |
385.468 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5047 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9290350; Lab Info: LP; Lab Number: LP-KV01000 |