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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 rsEHW01ZTT
Name N,O-DIMETHYL-1-DESMETHOXY-4,5-DIOXODEHYDRO-ASIMILOBINE
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.ACHENBACH,D.FREY,R.WAIBEL
Literature Reference Citation J.NAT.PROD.,54,1331(1991)
Literature Reference DOI 10.1021/np50077a016
Molecular Weight 291.306 g/mol
Solvent PYRIDINE-D5
Source File Reference UWTS834