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4H-1,2,4-Triazol-4-amine, 3-(2,4-dichlorophenyl)-5-(2,4,6-trimethylbenzylthio)-
SpectraBase Compound ID IOnBZorYDvF
InChI InChI=1S/C18H18Cl2N4S/c1-10-6-11(2)15(12(3)7-10)9-25-18-23-22-17(24(18)21)14-5-4-13(19)8-16(14)20/h4-8H,9,21H2,1-3H3
InChIKey KMZLBTCGCXKODM-UHFFFAOYSA-N
Mol Weight 393.34 g/mol
Molecular Formula C18H18Cl2N4S
Exact Mass 392.062923 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FjQjmRE4hfB
Name 4H-1,2,4-triazol-4-amine, 3-(2,4-dichlorophenyl)-5-[[(2,4,6-trimethylphenyl)methyl]thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 392.062923170 u
Formula C18H18Cl2N4S
InChI InChI=1S/C18H18Cl2N4S/c1-10-6-11(2)15(12(3)7-10)9-25-18-23-22-17(24(18)21)14-5-4-13(19)8-16(14)20/h4-8H,9,21H2,1-3H3
InChIKey KMZLBTCGCXKODM-UHFFFAOYSA-N
Molecular Weight 393.336 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6908
Solvent DMSO-d6
Source Vendor ID: NMR/9321257; Lab Info: LP; Lab Number: LP-2191651