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4H-pyran-3-carboxylic acid, 6-amino-5-cyano-2-methyl-4-(3-thienyl)-, phenylmethyl ester
SpectraBase Compound ID O2cCw953Q6
InChI InChI=1S/C19H16N2O3S/c1-12-16(19(22)23-10-13-5-3-2-4-6-13)17(14-7-8-25-11-14)15(9-20)18(21)24-12/h2-8,11,17H,10,21H2,1H3
InChIKey ZEHTUBUZWUKNAN-UHFFFAOYSA-N
Mol Weight 352.41 g/mol
Molecular Formula C19H16N2O3S
Exact Mass 352.088164 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G080Otr5oZV
Name 4H-pyran-3-carboxylic acid, 6-amino-5-cyano-2-methyl-4-(3-thienyl)-, 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/C19H16N2O3S/c1-12-16(19(22)23-10-13-5-3-2-4-6-13)17(14-7-8-25-11-14)15(9-20)18(21)24-12/h2-8,11,17H,10,21H2,1H3
InChIKey ZEHTUBUZWUKNAN-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_4231
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: 63TSH5.944; IOH_ID: IOH-011234