SpectraBase Spectrum ID |
LpYu2BxxmJ9 |
Name |
pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-[4-[(2-chloro-6-fluorophenyl)methoxy]phenyl]-3-(4-ethoxyphenyl)-1,4-dihydro- |
Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
516.136446444 u |
Formula |
C28H22ClFN4O3 |
InChI |
InChI=1S/C28H22ClFN4O3/c1-2-35-18-12-8-17(9-13-18)26-25-24(20(14-31)27(32)37-28(25)34-33-26)16-6-10-19(11-7-16)36-15-21-22(29)4-3-5-23(21)30/h3-13,24H,2,15,32H2,1H3,(H,33,34) |
InChIKey |
KVVOFBZOTPSCHO-UHFFFAOYSA-N |
Molecular Weight |
516.960 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_14122 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/10310458; Lab Info: VUR; Lab Number: VUR-0002274 |