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CAELESTINE_C;6-BROMO-8-METHOXY-4-OXO-DIHYDROQUINOLINE-2-CARBOXYLIC_ACID
SpectraBase Compound ID CWQUFxgkvej
InChI InChI=1S/C11H8BrNO4/c1-17-9-3-5(12)2-6-8(14)4-7(11(15)16)13-10(6)9/h2-4H,1H3,(H,13,14)(H,15,16)
InChIKey YPWADPOJPOTNKI-UHFFFAOYSA-N
Mol Weight 298.09 g/mol
Molecular Formula C11H8BrNO4
Exact Mass 296.963671 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EsXrWPM8m10
Name CAELESTINE_C;6-BROMO-8-METHOXY-4-OXO-DIHYDROQUINOLINE-2-CARBOXYLIC_ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H8BrNO4
InChI InChI=1S/C11H8BrNO4/c1-17-9-3-5(12)2-6-8(14)4-7(11(15)16)13-10(6)9/h2-4H,1H3,(H,13,14)(H,15,16)
InChIKey YPWADPOJPOTNKI-UHFFFAOYSA-N
Literature Reference Author S.YIN,G.M.BOYLE,A.R.CARROLL,M.KOTIW,J.DEARNALEY,R.J.QUINN,R. A.DAVIS
Literature Reference Citation J.NAT.PROD.,73,1586(2010)
Literature Reference DOI 10.1021/np100329w
Molecular Weight 298.093 g/mol
Sample ID 36187
Solvent CD3OD