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N,O-DIMETHYL-1-DESMETHOXY-4,5-DIOXODEHYDRO-ASIMILOBINE

View entire compound with spectra: 2 NMR, and 1 MS (GC)

N,O-DIMETHYL-1-DESMETHOXY-4,5-DIOXODEHYDRO-ASIMILOBINE
SpectraBase Compound ID 3KV6VrJiwCE
InChI InChI=1S/C18H13NO3/c1-19-15-7-10-5-3-4-6-12(10)13-8-11(22-2)9-14(16(13)15)17(20)18(19)21/h3-9H,1-2H3
InChIKey KUVUCKMFOMWZET-UHFFFAOYSA-N
Mol Weight 291.31 g/mol
Molecular Formula C18H13NO3
Exact Mass 291.089543 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fy9k4ETIX3f
Name O,N-DIMETHYL-1-DEMETHOXY-4,5-DIOXO-DEHYDROASIMILOBINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H13NO3
InChI InChI=1S/C18H13NO3/c1-19-15-7-10-5-3-4-6-12(10)13-8-11(22-2)9-14(16(13)15)17(20)18(19)21/h3-9H,1-2H3
InChIKey KUVUCKMFOMWZET-UHFFFAOYSA-N
Literature Reference Author H.GUINAUDEAU,M.LEBCEUF,A.CAVE
Literature Reference Citation J.NAT.PROD.,57,1033(1994)
Literature Reference DOI 10.1021/np50110a001
Molecular Weight 291.306 g/mol
Solvent PYRIDINE-D5
Source File Reference UWTS1552