SpectraBase Spectrum ID |
JgThCloHbnr |
Name |
pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-(3-chloro-4-hydroxy-5-methoxyphenyl)-1,4-dihydro-3-(4-methoxyphenyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
424.093832739 u |
Formula |
C21H17ClN4O4 |
InChI |
InChI=1S/C21H17ClN4O4/c1-28-12-5-3-10(4-6-12)18-17-16(11-7-14(22)19(27)15(8-11)29-2)13(9-23)20(24)30-21(17)26-25-18/h3-8,16,27H,24H2,1-2H3,(H,25,26) |
InChIKey |
QBFYQKFGQKYLMI-UHFFFAOYSA-N |
Molecular Weight |
424.844 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_10468 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: ZI/10037270; Lab Info: VUR; Lab Number: VUR-0001134 |