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acetic acid, [[3-cyano-5,6,7,8-tetrahydro-4-(4-hydroxyphenyl)-2-quinolinyl]thio]-, phenylmethyl ester
SpectraBase Compound ID GIN5oGakjGY
InChI InChI=1S/C25H22N2O3S/c26-14-21-24(18-10-12-19(28)13-11-18)20-8-4-5-9-22(20)27-25(21)31-16-23(29)30-15-17-6-2-1-3-7-17/h1-3,6-7,10-13,28H,4-5,8-9,15-16H2
InChIKey HYJXHVWPNGIWMA-UHFFFAOYSA-N
Mol Weight 430.52 g/mol
Molecular Formula C25H22N2O3S
Exact Mass 430.135114 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LnoYzKMS6uX
Name acetic acid, [[3-cyano-5,6,7,8-tetrahydro-4-(4-hydroxyphenyl)-2-quinolinyl]thio]-, phenylmethyl ester
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/C25H22N2O3S/c26-14-21-24(18-10-12-19(28)13-11-18)20-8-4-5-9-22(20)27-25(21)31-16-23(29)30-15-17-6-2-1-3-7-17/h1-3,6-7,10-13,28H,4-5,8-9,15-16H2
InChIKey HYJXHVWPNGIWMA-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_2318
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: NMR/9253114; Labnumber: DVD-0000069
Temperature 303 °C