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6-tert-butyl-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(2-thienyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
SpectraBase Compound ID EE05FrJuYEv
InChI InChI=1S/C27H28N2O2S2/c1-27(2,3)18-10-11-22-20(14-18)25(24-9-6-12-32-24)21(15-28)26(29-22)33-16-23(30)17-7-5-8-19(13-17)31-4/h5-9,12-13,18H,10-11,14,16H2,1-4H3
InChIKey NBOLPTPMLCASOK-UHFFFAOYSA-N
Mol Weight 476.65 g/mol
Molecular Formula C27H28N2O2S2
Exact Mass 476.15922 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Dd4raBPRXXY
Name 6-tert-butyl-2-{[2-(3-methoxyphenyl)-2-oxoethyl]sulfanyl}-4-(2-thienyl)-5,6,7,8-tetrahydro-3-quinolinecarbonitrile
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/C27H28N2O2S2/c1-27(2,3)18-10-11-22-20(14-18)25(24-9-6-12-32-24)21(15-28)26(29-22)33-16-23(30)17-7-5-8-19(13-17)31-4/h5-9,12-13,18H,10-11,14,16H2,1-4H3
InChIKey NBOLPTPMLCASOK-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10519
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: 132600; Labnumber: SHES1-156; VK_ID: VK-010523
Temperature 308 °C