SpectraBase Spectrum ID |
5NOOVfhcVM0 |
Name |
5-amino-1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-(3-fluorophenyl)-1H-1,2,3-triazole-4-carboxamide |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
418.095644259 u |
Formula |
C18H16ClFN6O3 |
InChI |
InChI=1S/C18H16ClFN6O3/c1-29-14-6-5-12(8-13(14)19)22-15(27)9-26-17(21)16(24-25-26)18(28)23-11-4-2-3-10(20)7-11/h2-8H,9,21H2,1H3,(H,22,27)(H,23,28) |
InChIKey |
OXQSTSZNNBPCRZ-UHFFFAOYSA-N |
Molecular Weight |
418.816 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_7335 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13218098 |