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METHYL-3-[2-(N-ACETYLAMINO-3-CYANO-9-METHOXY-4H-5,6-DIHYDRONAPHTHO-[1,2-B]-PYRAN-4-YL]-BENZOATE
SpectraBase Compound ID AAm4lnELZCW
InChI InChI=1S/C25H22N2O5/c1-14(28)27-24-21(13-26)22(16-5-4-6-17(11-16)25(29)31-3)19-10-8-15-7-9-18(30-2)12-20(15)23(19)32-24/h4-7,9,11-12,22H,8,10H2,1-3H3,(H,27,28)
InChIKey QGJOGZJXRVQBPZ-UHFFFAOYSA-N
Mol Weight 430.46 g/mol
Molecular Formula C25H22N2O5
Exact Mass 430.152872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IUCsLwohD6H
Name METHYL-3-[2-(N-ACETYLAMINO-3-CYANO-9-METHOXY-4H-5,6-DIHYDRONAPHTHO-[1,2-B]-PYRAN-4-YL]-BENZOATE
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H22N2O5
InChI InChI=1S/C25H22N2O5/c1-14(28)27-24-21(13-26)22(16-5-4-6-17(11-16)25(29)31-3)19-10-8-15-7-9-18(30-2)12-20(15)23(19)32-24/h4-7,9,11-12,22H,8,10H2,1-3H3,(H,27,28)
InChIKey QGJOGZJXRVQBPZ-UHFFFAOYSA-N
Literature Reference Author C.P.DELL,T.J.HOWE,W.G.PROWSE
Literature Reference Citation J.HETCYCL.CHEM.,31,749(1994)
Literature Reference DOI 10.1002/jhet.5570310410
Molecular Weight 430.460 g/mol
Solvent DMSO-D6