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2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxybenzyl)-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-methoxybenzyl)-5-nitro-2H-1,2,3-triazol-4-amine 3-oxide
SpectraBase Compound ID F2EJYRgGXcS
InChI InChI=1S/C18H17N5O6/c1-27-14-5-3-2-4-12(14)11-19-17-18(23(25)26)20-21(22(17)24)13-6-7-15-16(10-13)29-9-8-28-15/h2-7,10,19H,8-9,11H2,1H3
InChIKey KVZPECYEBUWWAT-UHFFFAOYSA-N
Mol Weight 399.36 g/mol
Molecular Formula C18H17N5O6
Exact Mass 399.117883 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ATONnVV1LZD
Name 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-(2-methoxybenzyl)-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 399.117883281 u
Formula C18H17N5O6
InChI InChI=1S/C18H17N5O6/c1-27-14-5-3-2-4-12(14)11-19-17-18(23(25)26)20-21(22(17)24)13-6-7-15-16(10-13)29-9-8-28-15/h2-7,10,19H,8-9,11H2,1H3
InChIKey KVZPECYEBUWWAT-UHFFFAOYSA-N
Molecular Weight 399.363 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5130
Solvent DMSO-d6
Source Vendor ID: NMR/12318394