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7-chloro-4-(2-chlorophenyl)-3-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-2-quinolinol
SpectraBase Compound ID JaJv6LPUHYj
InChI InChI=1S/C25H18Cl2N4OS/c1-2-31-23(15-8-4-3-5-9-15)29-30-25(31)33-22-21(17-10-6-7-11-19(17)27)18-13-12-16(26)14-20(18)28-24(22)32/h3-14H,2H2,1H3,(H,28,32)
InChIKey AEAOCARBKJPMAB-UHFFFAOYSA-N
Mol Weight 493.41 g/mol
Molecular Formula C25H18Cl2N4OS
Exact Mass 492.057838 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BLoLP8xB5k
Name 7-chloro-4-(2-chlorophenyl)-3-[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-2-quinolinol
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C25H18Cl2N4OS/c1-2-31-23(15-8-4-3-5-9-15)29-30-25(31)33-22-21(17-10-6-7-11-19(17)27)18-13-12-16(26)14-20(18)28-24(22)32/h3-14H,2H2,1H3,(H,28,32)
InChIKey AEAOCARBKJPMAB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_18195
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/9120510; UBI_ID: UBI-018198
Temperature 308 °C