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3-(benzylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine
SpectraBase Compound ID gOjkK3Axxn
InChI InChI=1S/C14H14N4S/c1-10-8-11(2)18-13(15-10)16-17-14(18)19-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKey GKTOUBDJSOUBHG-UHFFFAOYSA-N
Mol Weight 270.35 g/mol
Molecular Formula C14H14N4S
Exact Mass 270.093918 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 14r3hGZBegU
Name 3-(benzylsulfanyl)-5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidine
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/C14H14N4S/c1-10-8-11(2)18-13(15-10)16-17-14(18)19-9-12-6-4-3-5-7-12/h3-8H,9H2,1-2H3
InChIKey GKTOUBDJSOUBHG-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_484
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: 602509EX00072737; Labnumber: 602509EX00072737; VK_ID: VK-000485
Synonyms benzyl 5,7-dimethyl[1,2,4]triazolo[4,3-a]pyrimidin-3-yl sulfide
Temperature 308 °C