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8-Nitro-5-[[5-(phenoxymethyl)-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]quinoline
SpectraBase Compound ID FafCRuZtG0H
InChI InChI=1S/C24H17N5O3S/c30-29(31)20-13-14-21(19-12-7-15-25-23(19)20)33-24-27-26-22(16-32-18-10-5-2-6-11-18)28(24)17-8-3-1-4-9-17/h1-15H,16H2
InChIKey CAYNCODJBVZVDW-UHFFFAOYSA-N
Mol Weight 455.49 g/mol
Molecular Formula C24H17N5O3S
Exact Mass 455.105211 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KWKaKk0nGfo
Name quinoline, 8-nitro-5-[[5-(phenoxymethyl)-4-phenyl-4H-1,2,4-triazol-3-yl]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 455.105210598 u
Formula C24H17N5O3S
InChI InChI=1S/C24H17N5O3S/c30-29(31)20-13-14-21(19-12-7-15-25-23(19)20)33-24-27-26-22(16-32-18-10-5-2-6-11-18)28(24)17-8-3-1-4-9-17/h1-15H,16H2
InChIKey CAYNCODJBVZVDW-UHFFFAOYSA-N
Molecular Weight 455.492 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17300
Solvent DMSO-d6
Source Vendor ID: NMR/10311266; Lab Info: LP; Lab Number: LP-2101547