| SpectraBase Spectrum ID |
CyR2wBh4ck9 |
| Name |
acetamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[[7-[[4-(1,1-dimethylethyl)phenyl]methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
591.151859598 u |
| Formula |
C27H28ClF2N5O4S |
| InChI |
InChI=1S/C27H28ClF2N5O4S/c1-26(2,3)17-8-6-16(7-9-17)14-35-21-22(33(4)25(38)34(5)23(21)37)32-24(35)40-15-20(36)31-18-10-12-19(13-11-18)39-27(28,29)30/h6-13H,14-15H2,1-5H3,(H,31,36) |
| InChIKey |
OHDLQXMQGOGGML-UHFFFAOYSA-N |
| Molecular Weight |
592.062 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_16169 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10320261; Lab Info: SAD; Lab Number: 7 |
![acetamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[[7-[[4-(1,1-dimethylethyl)phenyl]methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-](/api/spectrum/CyR2wBh4ck9/structure.png?h=300&w=458 "acetamide, N-[4-(chlorodifluoromethoxy)phenyl]-2-[[7-[[4-(1,1-dimethylethyl)phenyl]methyl]-2,3,6,7-tetrahydro-1,3-dimethyl-2,6-dioxo-1H-purin-")
