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2-pyrimidinamine, N-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]-
SpectraBase Compound ID JjVAOchYLvE
InChI InChI=1S/C12H9ClN6/c13-9-4-2-8(3-5-9)10-16-12(19-18-10)17-11-14-6-1-7-15-11/h1-7H,(H2,14,15,16,17,18,19)
InChIKey RSUVVHLPWDWUSU-UHFFFAOYSA-N
Mol Weight 272.7 g/mol
Molecular Formula C12H9ClN6
Exact Mass 272.057722 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID bh5MeNB2W3
Name 2-pyrimidinamine, N-[5-(4-chlorophenyl)-1H-1,2,4-triazol-3-yl]-
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/C12H9ClN6/c13-9-4-2-8(3-5-9)10-16-12(19-18-10)17-11-14-6-1-7-15-11/h1-7H,(H2,14,15,16,17,18,19)
InChIKey RSUVVHLPWDWUSU-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_11523
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: F43203; Labnumber: VGU-114623
Temperature 315 °C