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3-isoxazolecarboxylic acid, 5-(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4,5-dihydro-4-methyl-, 2-[(E)-(2-fluorophenyl)methylidene]hydrazide

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3-isoxazolecarboxylic acid, 5-(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4,5-dihydro-4-methyl-, 2-[(E)-(2-fluorophenyl)methylidene]hydrazide
SpectraBase Compound ID DOzfErJTDUc
InChI InChI=1S/C21H19BrFN3O6/c1-10-15(21(27)25-24-8-11-6-4-5-7-12(11)23)26-32-16(10)13-14(22)18(29-3)20-19(17(13)28-2)30-9-31-20/h4-8,10,16H,9H2,1-3H3,(H,25,27)/b24-8+
InChIKey ADUZNBAZZCQJMS-KTZMUZOWSA-N
Mol Weight 508.3 g/mol
Molecular Formula C21H19BrFN3O6
Exact Mass 507.044127 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9xaESNjzHPx
Name 3-isoxazolecarboxylic acid, 5-(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)-4,5-dihydro-4-methyl-, 2-[(E)-(2-fluorophenyl)methylidene]hydrazide
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H19BrFN3O6/c1-10-15(21(27)25-24-8-11-6-4-5-7-12(11)23)26-32-16(10)13-14(22)18(29-3)20-19(17(13)28-2)30-9-31-20/h4-8,10,16H,9H2,1-3H3,(H,25,27)/b24-8+
InChIKey ADUZNBAZZCQJMS-KTZMUZOWSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5137
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/17311324; Labnumber: 169