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ethyl 6-amino-5-cyano-4-(2,3-dichlorophenyl)-2-{[(4-methylphenyl)sulfanyl]methyl}-4H-pyran-3-carboxylate
SpectraBase Compound ID K7oS2K2nqrf
InChI InChI=1S/C23H20Cl2N2O3S/c1-3-29-23(28)20-18(12-31-14-9-7-13(2)8-10-14)30-22(27)16(11-26)19(20)15-5-4-6-17(24)21(15)25/h4-10,19H,3,12,27H2,1-2H3
InChIKey YBPQPIPYQYSOJD-UHFFFAOYSA-N
Mol Weight 475.39 g/mol
Molecular Formula C23H20Cl2N2O3S
Exact Mass 474.057169 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2M1oSHgJAkj
Name ethyl 6-amino-5-cyano-4-(2,3-dichlorophenyl)-2-{[(4-methylphenyl)sulfanyl]methyl}-4H-pyran-3-carboxylate
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/C23H20Cl2N2O3S/c1-3-29-23(28)20-18(12-31-14-9-7-13(2)8-10-14)30-22(27)16(11-26)19(20)15-5-4-6-17(24)21(15)25/h4-10,19H,3,12,27H2,1-2H3
InChIKey YBPQPIPYQYSOJD-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10476
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: 132553; Labnumber: SHES1-104; VK_ID: VK-010480
Temperature 308 °C