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acetic acid, [4-bromo-5-methyl-2-(1-methylethyl)phenoxy]-, 2-[(E)-1,3-benzodioxol-5-ylmethylidene]hydrazide
SpectraBase Compound ID ADeu2qjYzoS
InChI InChI=1S/C20H21BrN2O4/c1-12(2)15-8-16(21)13(3)6-18(15)25-10-20(24)23-22-9-14-4-5-17-19(7-14)27-11-26-17/h4-9,12H,10-11H2,1-3H3,(H,23,24)/b22-9+
InChIKey NGXBMDKNCQPOKY-LSFURLLWSA-N
Mol Weight 433.3 g/mol
Molecular Formula C20H21BrN2O4
Exact Mass 432.06847 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CnBJapzqwVh
Name acetic acid, [4-bromo-5-methyl-2-(1-methylethyl)phenoxy]-, 2-[(E)-1,3-benzodioxol-5-ylmethylidene]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/C20H21BrN2O4/c1-12(2)15-8-16(21)13(3)6-18(15)25-10-20(24)23-22-9-14-4-5-17-19(7-14)27-11-26-17/h4-9,12H,10-11H2,1-3H3,(H,23,24)/b22-9+
InChIKey NGXBMDKNCQPOKY-LSFURLLWSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_272
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: AG-205/5029610; Labnumber: L-04/0002793; IOH_ID: IOH-007273