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4,6-pyrimidinediamine, 2-[[2-(4-chlorophenoxy)ethyl]thio]-
SpectraBase Compound ID D0ALX9mtO9f
InChI InChI=1S/C12H13ClN4OS/c13-8-1-3-9(4-2-8)18-5-6-19-12-16-10(14)7-11(15)17-12/h1-4,7H,5-6H2,(H4,14,15,16,17)
InChIKey QIEQWMMDKAXVSC-UHFFFAOYSA-N
Mol Weight 296.78 g/mol
Molecular Formula C12H13ClN4OS
Exact Mass 296.04986 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CVLCoQ9BFNn
Name 4,6-pyrimidinediamine, 2-[[2-(4-chlorophenoxy)ethyl]thio]-
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/C12H13ClN4OS/c13-8-1-3-9(4-2-8)18-5-6-19-12-16-10(14)7-11(15)17-12/h1-4,7H,5-6H2,(H4,14,15,16,17)
InChIKey QIEQWMMDKAXVSC-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_4610
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/11318734