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3-(4-Chloro-benzylsulfanyl)-5-furan-2-yl-4-methyl-4H-[1,2,4]triazole
SpectraBase Compound ID 8VNGOPKe5ud
InChI InChI=1S/C14H12ClN3OS/c1-18-13(12-3-2-8-19-12)16-17-14(18)20-9-10-4-6-11(15)7-5-10/h2-8H,9H2,1H3
InChIKey HVOIFSIXSRRUNQ-UHFFFAOYSA-N
Mol Weight 305.78 g/mol
Molecular Formula C14H12ClN3OS
Exact Mass 305.038961 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JVrt1bkwX6y
Name 4H-1,2,4-triazole, 3-[[(4-chlorophenyl)methyl]thio]-5-(2-furanyl)-4-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 305.038960891 u
Formula C14H12ClN3OS
InChI InChI=1S/C14H12ClN3OS/c1-18-13(12-3-2-8-19-12)16-17-14(18)20-9-10-4-6-11(15)7-5-10/h2-8H,9H2,1H3
InChIKey HVOIFSIXSRRUNQ-UHFFFAOYSA-N
Molecular Weight 305.783 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_10214
Solvent DMSO-d6
Source Vendor ID: NMR/10241511; Lab Info: LP; Lab Number: LP-2100591