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2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(cyclohexylmethyl)-4(3H)-quinazolinone
SpectraBase Compound ID IqNnHQkOZd
InChI InChI=1S/C23H23ClN2O2S/c24-18-12-10-17(11-13-18)21(27)15-29-23-25-20-9-5-4-8-19(20)22(28)26(23)14-16-6-2-1-3-7-16/h4-5,8-13,16H,1-3,6-7,14-15H2
InChIKey GQRVJYYWZSYREF-UHFFFAOYSA-N
Mol Weight 426.96 g/mol
Molecular Formula C23H23ClN2O2S
Exact Mass 426.116877 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BeCVuX0Dixz
Name 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-(cyclohexylmethyl)-4(3H)-quinazolinone
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/C23H23ClN2O2S/c24-18-12-10-17(11-13-18)21(27)15-29-23-25-20-9-5-4-8-19(20)22(28)26(23)14-16-6-2-1-3-7-16/h4-5,8-13,16H,1-3,6-7,14-15H2
InChIKey GQRVJYYWZSYREF-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_4250
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: 112344; Labnumber: AMIR-5209; VK_ID: VK-004251
Temperature 308 °C