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2-Amino-4-(4-methoxyphenyl)-6-methyl-5-(phenylthio)-4H-pyran-3-carbonitrile

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2-Amino-4-(4-methoxyphenyl)-6-methyl-5-(phenylthio)-4H-pyran-3-carbonitrile
SpectraBase Compound ID IrbJsqZ28xA
InChI InChI=1S/C20H18N2O2S/c1-13-19(25-16-6-4-3-5-7-16)18(17(12-21)20(22)24-13)14-8-10-15(23-2)11-9-14/h3-11,18H,22H2,1-2H3
InChIKey BUIWPVINFUSOMG-UHFFFAOYSA-N
Mol Weight 350.44 g/mol
Molecular Formula C20H18N2O2S
Exact Mass 350.108899 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7EuOd8tTo1m
Name 2-AMINO-4-(4-METHOXYPHENYL)-6-METHYL-5-(PHENYLTHIO)-4H-PYRAN-3-CARBONITRILE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H18N2O2S
InChI InChI=1S/C20H18N2O2S/c1-13-19(25-16-6-4-3-5-7-16)18(17(12-21)20(22)24-13)14-8-10-15(23-2)11-9-14/h3-11,18H,22H2,1-2H3
InChIKey BUIWPVINFUSOMG-UHFFFAOYSA-N
Literature Reference Author K.BOGDANOWICZ-SZWED,A.BUDZOWSKI
Literature Reference Citation MH.CHEM.,130,545(1999)
Literature Reference DOI 10.1007/s007060050212
Molecular Weight 350.435 g/mol
Solvent CDCl3