SpectraBase Spectrum ID |
3xwAW7Yr8y |
Name |
pyrazolo[1,5-a]pyrimidine-2-carboxamide, 3-chloro-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-5-(4-methoxyphenyl)-7- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
556.123750714 u |
Formula |
C26H20ClF3N6O3 |
InChI |
InChI=1S/C26H20ClF3N6O3/c1-14-21(25(38)36(34(14)2)16-7-5-4-6-8-16)32-24(37)22-20(27)23-31-18(15-9-11-17(39-3)12-10-15)13-19(26(28,29)30)35(23)33-22/h4-13H,1-3H3,(H,32,37) |
InChIKey |
URFHXSFNFUVJSO-UHFFFAOYSA-N |
Molecular Weight |
556.933 g/mol |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_3058 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9258428; Lab Info: *1058616*; Lab Number: BAS 1058616 |
Temperature |
23.85 °C |