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

*Links on SpectraBase are not permalinks.
1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[(4-bromo-2-fluorophenyl)methyl]-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-
SpectraBase Compound ID HIvxWmOvIhl
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
Mol Weight 448.25 g/mol
Molecular Formula C18H15BrFN5O3
Exact Mass 447.034231 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 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