SpectraBase Spectrum ID |
KH0PyRa4LnN |
Name |
1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(3,5-dimethoxyphenyl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
449.049880587 u |
Formula |
C18H17BrFN5O3 |
InChI |
InChI=1S/C18H17BrFN5O3/c1-27-13-6-12(7-14(8-13)28-2)22-18(26)16-17(21)25(24-23-16)9-10-3-4-11(19)5-15(10)20/h3-8H,9,21H2,1-2H3,(H,22,26) |
InChIKey |
PMGKMFPCSNCCBU-UHFFFAOYSA-N |
Molecular Weight |
450.268 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4311 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13279887 |