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4,6-pyrimidinediamine, 2-[[2-(3,4-dimethylphenoxy)ethyl]thio]-
SpectraBase Compound ID 9jFcx9q3IF6
InChI InChI=1S/C14H18N4OS/c1-9-3-4-11(7-10(9)2)19-5-6-20-14-17-12(15)8-13(16)18-14/h3-4,7-8H,5-6H2,1-2H3,(H4,15,16,17,18)
InChIKey IGUHBKRBUSXWBC-UHFFFAOYSA-N
Mol Weight 290.38 g/mol
Molecular Formula C14H18N4OS
Exact Mass 290.120132 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2pG1JE5GzF
Name 4,6-pyrimidinediamine, 2-[[2-(3,4-dimethylphenoxy)ethyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 290.120132389 u
Formula C14H18N4OS
InChI InChI=1S/C14H18N4OS/c1-9-3-4-11(7-10(9)2)19-5-6-20-14-17-12(15)8-13(16)18-14/h3-4,7-8H,5-6H2,1-2H3,(H4,15,16,17,18)
InChIKey IGUHBKRBUSXWBC-UHFFFAOYSA-N
Molecular Weight 290.385 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10643
Solvent DMSO-d6
Source Vendor ID: NMR/10252294; Lab Info: LD; Lab Number: LD-P430010
Temperature 23.85 °C