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quinoline, 5-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio]-8-nitro-
SpectraBase Compound ID EVi1eoyAAbg
InChI InChI=1S/C23H15N5O2S/c29-28(30)19-13-14-20(18-12-7-15-24-21(18)19)31-23-26-25-22(16-8-3-1-4-9-16)27(23)17-10-5-2-6-11-17/h1-15H
InChIKey LLGPESOSISBEEW-UHFFFAOYSA-N
Mol Weight 425.47 g/mol
Molecular Formula C23H15N5O2S
Exact Mass 425.094646 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HFUrvQXbAy7
Name quinoline, 5-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)thio]-8-nitro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 425.094645915 u
Formula C23H15N5O2S
InChI InChI=1S/C23H15N5O2S/c29-28(30)19-13-14-20(18-12-7-15-24-21(18)19)31-23-26-25-22(16-8-3-1-4-9-16)27(23)17-10-5-2-6-11-17/h1-15H
InChIKey LLGPESOSISBEEW-UHFFFAOYSA-N
Molecular Weight 425.466 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_796
Solvent DMSO-d6
Source Vendor ID: ZI/8113754; Lab Info: LP; Lab Number: LP-2080432
Temperature 29.85 °C