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Benzyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate
SpectraBase Compound ID Huqwa2bz1Rs
InChI InChI=1S/C21H18N2O3/c1-14-18(21(24)25-13-15-8-4-2-5-9-15)19(16-10-6-3-7-11-16)17(12-22)20(23)26-14/h2-11,19H,13,23H2,1H3
InChIKey JOHBVQLLXJSGKQ-UHFFFAOYSA-N
Mol Weight 346.39 g/mol
Molecular Formula C21H18N2O3
Exact Mass 346.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kp3sF1LgfA2
Name BENZYL-6-AMINO-5-CYANO-2-METHYL-4-PHENYL-4H-PYRAN-3-CARBOXYLATE
Compound Number 6F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H18N2O3
InChI InChI=1S/C21H18N2O3/c1-14-18(21(24)25-13-15-8-4-2-5-9-15)19(16-10-6-3-7-11-16)17(12-22)20(23)26-14/h2-11,19H,13,23H2,1H3
InChIKey JOHBVQLLXJSGKQ-UHFFFAOYSA-N
Literature Reference Author N.M.H.ELNAGDI,N.S.A.HOKBANY
Literature Reference Citation MOLECULES,17,4300(2012)
Literature Reference DOI 10.3390/molecules17044300
Molecular Weight 346.386 g/mol
Sample ID 1724
Solvent DMSO-D6