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3-AMINO-2-BENZOYL-3-(2-IMINO-4-METHYL-2H-1-BENZOPYRAN-3-YL)-PROP-2-ENE-NITRILE

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3-AMINO-2-BENZOYL-3-(2-IMINO-4-METHYL-2H-1-BENZOPYRAN-3-YL)-PROP-2-ENE-NITRILE
SpectraBase Compound ID ECW49DMobDZ
InChI InChI=1S/C20H15N3O2/c1-12-14-9-5-6-10-16(14)25-20(23)17(12)18(22)15(11-21)19(24)13-7-3-2-4-8-13/h2-10,23H,22H2,1H3/b18-15-,23-20?
InChIKey KQTIJCROSCQOLP-CRDZGBNOSA-N
Mol Weight 329.36 g/mol
Molecular Formula C20H15N3O2
Exact Mass 329.116427 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HabhEi5AegC
Name 3-AMINO-2-BENZOYL-3-(2-IMINO-4-METHYL-2H-1-BENZOPYRAN-3-YL)-PROP-2-ENE-NITRILE
Compound Number 7
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H15N3O2/c1-12-14-9-5-6-10-16(14)25-20(23)17(12)18(22)15(11-21)19(24)13-7-3-2-4-8-13/h2-10,23H,22H2,1H3/b18-15-,23-20?
InChIKey KQTIJCROSCQOLP-CRDZGBNOSA-N
Literature Reference C.N.OCALLAGHAN,T.B.H.MCMURRY,J.E.OBRIEN,S.M.DRAPER,D.J.WILCOCK J.CHEM.SOC.PERKIN-1,1067(1996)
Solvent Dimethyl sulfoxide-d6