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2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-pyrimidinyl)acetamide
SpectraBase Compound ID CSmQJ3tEcP2
InChI InChI=1S/C9H10N6OS/c1-6-12-9(15-14-6)17-5-7(16)13-8-10-3-2-4-11-8/h2-4H,5H2,1H3,(H,12,14,15)(H,10,11,13,16)
InChIKey NKQMPOPWEYQAAK-UHFFFAOYSA-N
Mol Weight 250.28 g/mol
Molecular Formula C9H10N6OS
Exact Mass 250.06368 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Weqf7IKocv
Name 2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(2-pyrimidinyl)acetamide
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/C9H10N6OS/c1-6-12-9(15-14-6)17-5-7(16)13-8-10-3-2-4-11-8/h2-4H,5H2,1H3,(H,12,14,15)(H,10,11,13,16)
InChIKey NKQMPOPWEYQAAK-UHFFFAOYSA-N
NMR Offset 18.0216
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7000_2975
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: ZI/7015910; Labnumber: L-23/0003943; IOH_ID: IOH-002976
Temperature 297 °C