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2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-methylphenyl)ethyl]-5-nitro-2H-1,2,3-triazol-4-amine 3-oxide
SpectraBase Compound ID HcJnjzqQDBB
InChI InChI=1S/C19H19N5O5/c1-13-2-4-14(5-3-13)8-9-20-18-19(24(26)27)21-22(23(18)25)15-6-7-16-17(12-15)29-11-10-28-16/h2-7,12,20H,8-11H2,1H3
InChIKey LECHKFKINQZJFM-UHFFFAOYSA-N
Mol Weight 397.39 g/mol
Molecular Formula C19H19N5O5
Exact Mass 397.138619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8G7gLX8REGB
Name 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(4-methylphenyl)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 397.138618727 u
Formula C19H19N5O5
InChI InChI=1S/C19H19N5O5/c1-13-2-4-14(5-3-13)8-9-20-18-19(24(26)27)21-22(23(18)25)15-6-7-16-17(12-15)29-11-10-28-16/h2-7,12,20H,8-11H2,1H3
InChIKey LECHKFKINQZJFM-UHFFFAOYSA-N
Molecular Weight 397.391 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5134
Solvent DMSO-d6
Source Vendor ID: NMR/12318398