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4H-1,2,4-triazol-4-amine, 3-[[(2-chloro-4,5-difluorophenyl)methyl]thio]-5-phenyl-
SpectraBase Compound ID 5i9Z8znPHub
InChI InChI=1S/C15H11ClF2N4S/c16-11-7-13(18)12(17)6-10(11)8-23-15-21-20-14(22(15)19)9-4-2-1-3-5-9/h1-7H,8,19H2
InChIKey VBBQIMGYMNWJGK-UHFFFAOYSA-N
Mol Weight 352.79 g/mol
Molecular Formula C15H11ClF2N4S
Exact Mass 352.036102 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FKmvmbQvGc3
Name 4H-1,2,4-triazol-4-amine, 3-[[(2-chloro-4,5-difluorophenyl)methyl]thio]-5-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 352.036101570 u
Formula C15H11ClF2N4S
InChI InChI=1S/C15H11ClF2N4S/c16-11-7-13(18)12(17)6-10(11)8-23-15-21-20-14(22(15)19)9-4-2-1-3-5-9/h1-7H,8,19H2
InChIKey VBBQIMGYMNWJGK-UHFFFAOYSA-N
Molecular Weight 352.791 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7869
Solvent DMSO-d6
Source Vendor ID: NMR/10231857; Lab Info: LP; Lab Number: LP-2100419
Temperature 23.85 °C