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methyl 6-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-5-cyano-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID F4uFqaOofPD
InChI InChI=1S/C24H23ClN2O3S/c1-13-9-14(2)19(10-16(13)12-31-18-7-5-17(25)6-8-18)22-20(11-26)23(27)30-15(3)21(22)24(28)29-4/h5-10,22H,12,27H2,1-4H3
InChIKey MVIKBCWWWKTBQK-UHFFFAOYSA-N
Mol Weight 454.97 g/mol
Molecular Formula C24H23ClN2O3S
Exact Mass 454.111791 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID APlQp7XDznS
Name methyl 6-amino-4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-5-cyano-2-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/C24H23ClN2O3S/c1-13-9-14(2)19(10-16(13)12-31-18-7-5-17(25)6-8-18)22-20(11-26)23(27)30-15(3)21(22)24(28)29-4/h5-10,22H,12,27H2,1-4H3
InChIKey MVIKBCWWWKTBQK-UHFFFAOYSA-N
NMR Offset 17.5268
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14278
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: UZI/1012889; UBI_ID: UBI-014281
Temperature 300 °C