SpectraBase Spectrum ID |
93x7BPTWhzX |
Name |
benzoic acid, 4-(6-amino-5-cyano-1,4-dihydro-3-phenylpyrano[2,3-c]pyrazol-4-yl)-, methyl ester |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
372.122240388 u |
Formula |
C21H16N4O3 |
InChI |
InChI=1S/C21H16N4O3/c1-27-21(26)14-9-7-12(8-10-14)16-15(11-22)19(23)28-20-17(16)18(24-25-20)13-5-3-2-4-6-13/h2-10,16H,23H2,1H3,(H,24,25) |
InChIKey |
BONSHFTVXCKZDZ-UHFFFAOYSA-N |
Molecular Weight |
372.384 g/mol |
NMR Offset |
17.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2017_5601 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/9290639; Lab Info: VUR; Lab Number: VUR-0000519 |