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5-(3,4-Dichloro-phenoxymethyl)-4-phenyl-4H-[1,2,4]triazole-3-thiol
SpectraBase Compound ID 78VcJbb14Lw
InChI InChI=1S/C15H11Cl2N3OS/c16-12-7-6-11(8-13(12)17)21-9-14-18-19-15(22)20(14)10-4-2-1-3-5-10/h1-8H,9H2,(H,19,22)
InChIKey ZHSPTKKOHKPZDI-UHFFFAOYSA-N
Mol Weight 352.24 g/mol
Molecular Formula C15H11Cl2N3OS
Exact Mass 350.999989 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2x87yM1Jfm1
Name 4H-1,2,4-triazole-3-thiol, 5-[(3,4-dichlorophenoxy)methyl]-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 350.999988559 u
Formula C15H11Cl2N3OS
InChI InChI=1S/C15H11Cl2N3OS/c16-12-7-6-11(8-13(12)17)21-9-14-18-19-15(22)20(14)10-4-2-1-3-5-10/h1-8H,9H2,(H,19,22)
InChIKey ZHSPTKKOHKPZDI-UHFFFAOYSA-N
Molecular Weight 352.239 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5833
Solvent DMSO-d6
Source Vendor ID: NMR/9215385; Lab Info: LP; Lab Number: LP-2181290