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2-oxo-2-(2,2,4-trimethyl-4-phenyl-3,4-dihydro-1(2H)-quinolinyl)ethyl 5-phenyl-4H-1,2,4-triazol-3-yl sulfide

View entire compound with spectra: 1 NMR

2-oxo-2-(2,2,4-trimethyl-4-phenyl-3,4-dihydro-1(2H)-quinolinyl)ethyl 5-phenyl-4H-1,2,4-triazol-3-yl sulfide
SpectraBase Compound ID boppfRYhdz
InChI InChI=1S/C28H28N4OS/c1-27(2)19-28(3,21-14-8-5-9-15-21)22-16-10-11-17-23(22)32(27)24(33)18-34-26-29-25(30-31-26)20-12-6-4-7-13-20/h4-17H,18-19H2,1-3H3,(H,29,30,31)
InChIKey XBHHZEYOENTBHK-UHFFFAOYSA-N
Mol Weight 468.62 g/mol
Molecular Formula C28H28N4OS
Exact Mass 468.198383 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JFQifvDn6ty
Name 2-oxo-2-(2,2,4-trimethyl-4-phenyl-3,4-dihydro-1(2H)-quinolinyl)ethyl 5-phenyl-4H-1,2,4-triazol-3-yl sulfide
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/C28H28N4OS/c1-27(2)19-28(3,21-14-8-5-9-15-21)22-16-10-11-17-23(22)32(27)24(33)18-34-26-29-25(30-31-26)20-12-6-4-7-13-20/h4-17H,18-19H2,1-3H3,(H,29,30,31)
InChIKey XBHHZEYOENTBHK-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_5853
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: 123067; Labnumber: VGU-15015; VK_ID: VK-005856
Synonyms 2,2,4-trimethyl-4-phenyl-1-{[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetyl}-1,2,3,4-tetrahydroquinoline
Temperature 308 °C