SpectraBase Spectrum ID |
KnlK5a0r68A |
Name |
1H-purine-2,6-dione, 1-[(3-fluorophenyl)methyl]-3,7-dihydro-3,7-dimethyl- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
288.102253836 u |
Formula |
C14H13FN4O2 |
InChI |
InChI=1S/C14H13FN4O2/c1-17-8-16-12-11(17)13(20)19(14(21)18(12)2)7-9-4-3-5-10(15)6-9/h3-6,8H,7H2,1-2H3 |
InChIKey |
HARFIXZCUOCVGL-UHFFFAOYSA-N |
Molecular Weight |
288.282 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_3969 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/9038534; Lab Info: SAD; Lab Number: SAD-star785 |
Temperature |
29.85 °C |