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CANTHIN-16-ONE-14-BUTYRIC-ACID
SpectraBase Compound ID HqL1m7GgX9C
InChI InChI=1S/C18H14N2O3/c21-15-10-11(4-3-7-16(22)23)17-18-13(8-9-19-17)12-5-1-2-6-14(12)20(15)18/h1-2,5-6,8-10H,3-4,7H2,(H,22,23)
InChIKey PNMZJHJOLNMFBK-UHFFFAOYSA-N
Mol Weight 306.32 g/mol
Molecular Formula C18H14N2O3
Exact Mass 306.100442 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3aWWoiYyKzh
Name CANTHIN-16-ONE-14-BUTYRIC-ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H14N2O3
InChI InChI=1S/C18H14N2O3/c21-15-10-11(4-3-7-16(22)23)17-18-13(8-9-19-17)12-5-1-2-6-14(12)20(15)18/h1-2,5-6,8-10H,3-4,7H2,(H,22,23)
InChIKey PNMZJHJOLNMFBK-UHFFFAOYSA-N
Literature Reference Author W.H.JIAO,H.GAO,F.ZHAO,H.W.LIN,Y.M.PAN,G.X.ZHOU,X.S.YAO
Literature Reference Citation CHEM.PHARM.BULL.,59,359(2011)
Literature Reference DOI 10.1248/cpb.59.359
Molecular Weight 306.321 g/mol
Sample ID 2775
Solvent DMSO-D6