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6-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N~2~-phenyl-1,3,5-triazine-2,4-diamine
SpectraBase Compound ID Cqr7DU0Ymbm
InChI InChI=1S/C13H14N8S/c1-21-8-15-20-13(21)22-7-10-17-11(14)19-12(18-10)16-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H3,14,16,17,18,19)
InChIKey WJZIIGNMGVAYPC-UHFFFAOYSA-N
Mol Weight 314.37 g/mol
Molecular Formula C13H14N8S
Exact Mass 314.106214 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID He5XgmZDa8s
Name 6-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N~2~-phenyl-1,3,5-triazine-2,4-diamine
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/C13H14N8S/c1-21-8-15-20-13(21)22-7-10-17-11(14)19-12(18-10)16-9-5-3-2-4-6-9/h2-6,8H,7H2,1H3,(H3,14,16,17,18,19)
InChIKey WJZIIGNMGVAYPC-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_1810
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/8211551; Labnumber: LP-2180299; IOH_ID: IOH-001811
Synonyms N-(4-amino-6-{[(4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1,3,5-triazin-2-yl)-N-phenylamine
Temperature 297 °C