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2-{[2-oxo-2-(2,2,4,6-tetramethyl-3,4-dihydro-1(2H)-quinolinyl)ethyl]sulfanyl}-6-phenyl-4-pyrimidinol
SpectraBase Compound ID Bbochabm7ug
InChI InChI=1S/C25H27N3O2S/c1-16-10-11-21-19(12-16)17(2)14-25(3,4)28(21)23(30)15-31-24-26-20(13-22(29)27-24)18-8-6-5-7-9-18/h5-13,17H,14-15H2,1-4H3,(H,26,27,29)
InChIKey ZQQBWXNFGPEBLJ-UHFFFAOYSA-N
Mol Weight 433.57 g/mol
Molecular Formula C25H27N3O2S
Exact Mass 433.182398 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID k2xWb7BzXg
Name 2-{[2-oxo-2-(2,2,4,6-tetramethyl-3,4-dihydro-1(2H)-quinolinyl)ethyl]sulfanyl}-6-phenyl-4-pyrimidinol
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/C25H27N3O2S/c1-16-10-11-21-19(12-16)17(2)14-25(3,4)28(21)23(30)15-31-24-26-20(13-22(29)27-24)18-8-6-5-7-9-18/h5-13,17H,14-15H2,1-4H3,(H,26,27,29)
InChIKey ZQQBWXNFGPEBLJ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20009
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: D15622; Labnumber: VGU-15577; SBI_ID: SBI-020013
Temperature 306 °C