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2-(benzo[d][1,3]dioxol-5-ylmethylene)-1-(6-((2-bromo-4-methylphenyl)amino)-4-morpholino-1,3,5-triazin-2(1H)-ylidene)hydrazin-1-ium chloride

View entire compound with spectra: 1 NMR

2-(benzo[d][1,3]dioxol-5-ylmethylene)-1-(6-((2-bromo-4-methylphenyl)amino)-4-morpholino-1,3,5-triazin-2(1H)-ylidene)hydrazin-1-ium chloride
SpectraBase Compound ID 8NnqcekERi7
InChI InChI=1S/C22H23BrN7O3.ClH/c1-14-2-4-17(16(23)10-14)25-20-26-21(28-22(27-20)30-6-8-31-9-7-30)29-24-12-15-3-5-18-19(11-15)33-13-32-18;/h2-5,10-12,29H,6-9,13H2,1H3,(H2,25,26,27,28);1H/q+1;/p-1/b24-12+;
InChIKey VTILIIDJJNYSBW-DFVQGABXSA-M
Mol Weight 548.83 g/mol
Molecular Formula C22H23BrClN7O3
Exact Mass 547.073428 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GMh9xzHKYsy
Name 2-(benzo[d][1,3]dioxol-5-ylmethylene)-1-(6-((2-bromo-4-methylphenyl)amino)-4-morpholino-1,3,5-triazin-2(1H)-ylidene)hydrazin-1-ium chloride
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/C22H23BrN7O3.ClH/c1-14-2-4-17(16(23)10-14)25-20-26-21(28-22(27-20)30-6-8-31-9-7-30)29-24-12-15-3-5-18-19(11-15)33-13-32-18;/h2-5,10-12,29H,6-9,13H2,1H3,(H2,25,26,27,28);1H/q+1;/p-1/b24-12+;
InChIKey VTILIIDJJNYSBW-DFVQGABXSA-M
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_7230
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: SADD/5681117; IOH_ID: IOH-014234