For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
5-amino-1-[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]-N-(3-fluorophenyl)-1H-1,2,3-triazole-4-carboxamide
SpectraBase Compound ID 40kwPoTb9GZ
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
Mol Weight 418.82 g/mol
Molecular Formula C18H16ClFN6O3
Exact Mass 418.095644 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

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