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3-(2-Methyl-3-furanyl)-4-phenyl-1H-1,2,4-triazole-5-thione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(2-Methyl-3-furanyl)-4-phenyl-1H-1,2,4-triazole-5-thione
SpectraBase Compound ID 5UoyxCLllT7
InChI InChI=1S/C13H11N3OS/c1-9-11(7-8-17-9)12-14-15-13(18)16(12)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,18)
InChIKey UGMHSMHHRNSVFZ-UHFFFAOYSA-N
Mol Weight 257.31 g/mol
Molecular Formula C13H11N3OS
Exact Mass 257.062283 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AVixVnGeLCB
Name 4H-1,2,4-triazole-3-thiol, 5-(2-methyl-3-furanyl)-4-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 257.062283159 u
Formula C13H11N3OS
InChI InChI=1S/C13H11N3OS/c1-9-11(7-8-17-9)12-14-15-13(18)16(12)10-5-3-2-4-6-10/h2-8H,1H3,(H,15,18)
InChIKey UGMHSMHHRNSVFZ-UHFFFAOYSA-N
Molecular Weight 257.311 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13846
Solvent DMSO-d6
Source Vendor ID: NMR/10300400; Lab Info: LP; Lab Number: LP-2181006