SpectraBase Spectrum ID |
6mYPnp6Y7G5 |
Name |
acetamide, 2-[[7-[(3-chlorophenyl)methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-8-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 |
393.066238266 u |
Formula |
C16H16ClN5O3S |
InChI |
InChI=1S/C16H16ClN5O3S/c1-20-13-12(14(24)21(2)16(20)25)22(15(19-13)26-8-11(18)23)7-9-4-3-5-10(17)6-9/h3-6H,7-8H2,1-2H3,(H2,18,23) |
InChIKey |
TUNPPVXEISLHSJ-UHFFFAOYSA-N |
Molecular Weight |
393.849 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_10309 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10241083; Lab Info: SAD; Lab Number: SAD-0001662 |