SpectraBase Spectrum ID |
3rH2vDCD0Qh |
Name |
1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)- |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
447.034230523 u |
Formula |
C18H15BrFN5O3 |
InChI |
InChI=1S/C18H15BrFN5O3/c19-11-2-1-10(13(20)7-11)9-25-17(21)16(23-24-25)18(26)22-12-3-4-14-15(8-12)28-6-5-27-14/h1-4,7-8H,5-6,9,21H2,(H,22,26) |
InChIKey |
BVVAVNKQDMDZST-UHFFFAOYSA-N |
Molecular Weight |
448.252 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_4317 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13279893 |