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1-(2,3-dimethylphenyl)-5-(3-pyridinylmethyl)tetrahydro-1,3,5-triazine-2(1H)-thione
SpectraBase Compound ID ddm3RVu7uy
InChI InChI=1S/C17H20N4S/c1-13-5-3-7-16(14(13)2)21-12-20(11-19-17(21)22)10-15-6-4-8-18-9-15/h3-9H,10-12H2,1-2H3,(H,19,22)
InChIKey AHUDIZFOZODGJA-UHFFFAOYSA-N
Mol Weight 312.44 g/mol
Molecular Formula C17H20N4S
Exact Mass 312.140868 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HdDixOwOcge
Name 1-(2,3-dimethylphenyl)-5-(3-pyridinylmethyl)tetrahydro-1,3,5-triazine-2(1H)-thione
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/C17H20N4S/c1-13-5-3-7-16(14(13)2)21-12-20(11-19-17(21)22)10-15-6-4-8-18-9-15/h3-9H,10-12H2,1-2H3,(H,19,22)
InChIKey AHUDIZFOZODGJA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3319
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: D10109; Labnumber: KHAN-0796; SBI_ID: SBI-003321
Temperature 308 °C