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methyl 6-amino-5-cyano-4-{4-methoxy-3-[(2-pyridinylsulfanyl)methyl]phenyl}-2-methyl-4H-pyran-3-carboxylate
SpectraBase Compound ID AdNsdG53qdX
InChI InChI=1S/C22H21N3O4S/c1-13-19(22(26)28-3)20(16(11-23)21(24)29-13)14-7-8-17(27-2)15(10-14)12-30-18-6-4-5-9-25-18/h4-10,20H,12,24H2,1-3H3
InChIKey QASRPFBCMHEBTB-UHFFFAOYSA-N
Mol Weight 423.49 g/mol
Molecular Formula C22H21N3O4S
Exact Mass 423.125277 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 44IvBsVIzj9
Name methyl 6-amino-5-cyano-4-{4-methoxy-3-[(2-pyridinylsulfanyl)methyl]phenyl}-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/C22H21N3O4S/c1-13-19(22(26)28-3)20(16(11-23)21(24)29-13)14-7-8-17(27-2)15(10-14)12-30-18-6-4-5-9-25-18/h4-10,20H,12,24H2,1-3H3
InChIKey QASRPFBCMHEBTB-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16102
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/8070120; UBI_ID: UBI-016105
Temperature 308 °C