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ethanone, 1-(1-methyl-1H-indol-3-yl)-2-(4H-1,2,4-triazol-3-ylthio)-
SpectraBase Compound ID 2YfGMFLhvqZ
InChI InChI=1S/C13H12N4OS/c1-17-6-10(9-4-2-3-5-11(9)17)12(18)7-19-13-14-8-15-16-13/h2-6,8H,7H2,1H3,(H,14,15,16)
InChIKey BCWWMMYHPPBEMV-UHFFFAOYSA-N
Mol Weight 272.33 g/mol
Molecular Formula C13H12N4OS
Exact Mass 272.073182 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8Z7IeFKoWzE
Name ethanone, 1-(1-methyl-1H-indol-3-yl)-2-(4H-1,2,4-triazol-3-ylthio)-
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/C13H12N4OS/c1-17-6-10(9-4-2-3-5-11(9)17)12(18)7-19-13-14-8-15-16-13/h2-6,8H,7H2,1H3,(H,14,15,16)
InChIKey BCWWMMYHPPBEMV-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5165
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: F24556; Labnumber: ALEKS1-29964