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2-tert-butyl-5-(methylsulfanyl)-7-phenyl[1,2,4]triazolo[1,5-a]pyrimidine
SpectraBase Compound ID C3dz86G8skL
InChI InChI=1S/C16H18N4S/c1-16(2,3)14-18-15-17-13(21-4)10-12(20(15)19-14)11-8-6-5-7-9-11/h5-10H,1-4H3
InChIKey GSILNMYOPHPOOC-UHFFFAOYSA-N
Mol Weight 298.41 g/mol
Molecular Formula C16H18N4S
Exact Mass 298.125218 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IXWmczp0crK
Name 2-tert-butyl-5-(methylsulfanyl)-7-phenyl[1,2,4]triazolo[1,5-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/C16H18N4S/c1-16(2,3)14-18-15-17-13(21-4)10-12(20(15)19-14)11-8-6-5-7-9-11/h5-10H,1-4H3
InChIKey GSILNMYOPHPOOC-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_15248
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: 987/00001601; Labnumber: 987/00001601218818; VK_ID: VK-015253
Synonyms 2-tert-butyl-7-phenyl[1,2,4]triazolo[1,5-a]pyrimidin-5-yl methyl sulfide
Temperature 318 °C