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4H-1,2,4-triazole-4-ethanol, 3-mercapto-5-(4-pyridinyl)-

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4H-1,2,4-triazole-4-ethanol, 3-mercapto-5-(4-pyridinyl)-
SpectraBase Compound ID Dp7RkHvQElH
InChI InChI=1S/C9H10N4OS/c14-6-5-13-8(11-12-9(13)15)7-1-3-10-4-2-7/h1-4,14H,5-6H2,(H,12,15)
InChIKey VSVILMSLOKVXSA-UHFFFAOYSA-N
Mol Weight 222.27 g/mol
Molecular Formula C9H10N4OS
Exact Mass 222.057532 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LEad8PmyYRW
Name 4H-1,2,4-triazole-4-ethanol, 3-mercapto-5-(4-pyridinyl)-
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/C9H10N4OS/c14-6-5-13-8(11-12-9(13)15)7-1-3-10-4-2-7/h1-4,14H,5-6H2,(H,12,15)
InChIKey VSVILMSLOKVXSA-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_4978
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: F23499; Labnumber: BAL5-1827