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2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-5-nitro-2H-1,2,3-triazol-4-amine 3-oxide
SpectraBase Compound ID 5S3OW5smw2
InChI InChI=1S/C20H21N5O7/c1-29-15-5-3-13(11-17(15)30-2)7-8-21-19-20(25(27)28)22-23(24(19)26)14-4-6-16-18(12-14)32-10-9-31-16/h3-6,11-12,21H,7-10H2,1-2H3
InChIKey FQDIXADJRFTAAD-UHFFFAOYSA-N
Mol Weight 443.42 g/mol
Molecular Formula C20H21N5O7
Exact Mass 443.144098 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BEdyEYDh1cx
Name 2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[2-(3,4-dimethoxyphenyl)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 443.144098029 u
Formula C20H21N5O7
InChI InChI=1S/C20H21N5O7/c1-29-15-5-3-13(11-17(15)30-2)7-8-21-19-20(25(27)28)22-23(24(19)26)14-4-6-16-18(12-14)32-10-9-31-16/h3-6,11-12,21H,7-10H2,1-2H3
InChIKey FQDIXADJRFTAAD-UHFFFAOYSA-N
Molecular Weight 443.416 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_5135
Solvent DMSO-d6
Source Vendor ID: NMR/12318399