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

*Links on SpectraBase are not permalinks.

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{2-[4-(2-fluorophenyl)-1-piperazinyl]ethyl}-5-nitro-2H-1,2,3-triazol-4-amine 3-oxide

View entire compound with spectra: 1 NMR

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{2-[4-(2-fluorophenyl)-1-piperazinyl]ethyl}-5-nitro-2H-1,2,3-triazol-4-amine 3-oxide
SpectraBase Compound ID E6M3C9MT6sZ
InChI InChI=1S/C22H24FN7O5/c23-17-3-1-2-4-18(17)27-11-9-26(10-12-27)8-7-24-21-22(30(32)33)25-28(29(21)31)16-5-6-19-20(15-16)35-14-13-34-19/h1-6,15,24H,7-14H2
InChIKey LKENKODUBNWNQW-UHFFFAOYSA-N
Mol Weight 485.48 g/mol
Molecular Formula C22H24FN7O5
Exact Mass 485.182295 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 Ej8tNFHPVUA
Name 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-{2-[4-(2-fluorophenyl)-1-piperazinyl]ethyl}-5-nitro-2H-1,2,3-triazol-4-amine 3-oxide
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 485.182295059 u
Formula C22H24FN7O5
InChI InChI=1S/C22H24FN7O5/c23-17-3-1-2-4-18(17)27-11-9-26(10-12-27)8-7-24-21-22(30(32)33)25-28(29(21)31)16-5-6-19-20(15-16)35-14-13-34-19/h1-6,15,24H,7-14H2
InChIKey LKENKODUBNWNQW-UHFFFAOYSA-N
Molecular Weight 485.476 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5848
Solvent DMSO-d6
Source Vendor ID: NMR/12319336