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BRANACENOIC-ACID
SpectraBase Compound ID EUJk9C9k8zY
InChI InChI=1S/C24H32O8/c1-13(2)11-20(27)22(31-15(4)25)19-12-30-24(32-16(5)26)21-14(3)7-6-8-17(23(28)29)9-10-18(19)21/h8,12-13,18,21-22,24H,3,6-7,9-11H2,1-2,4-5H3,(H,28,29)/b17-8+
InChIKey HQRZGHVJJMLINH-CAOOACKPSA-N
Mol Weight 448.5 g/mol
Molecular Formula C24H32O8
Exact Mass 448.209718 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Jtfl0GqGA1
Name BRANACENOIC-ACID
Compound Number 22
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H32O8
InChI InChI=1S/C24H32O8/c1-13(2)11-20(27)22(31-15(4)25)19-12-30-24(32-16(5)26)21-14(3)7-6-8-17(23(28)29)9-10-18(19)21/h8,12-13,18,21-22,24H,3,6-7,9-11H2,1-2,4-5H3,(H,28,29)/b17-8+
InChIKey HQRZGHVJJMLINH-CAOOACKPSA-N
Literature Reference Author A.ALMOURABIT,A.AHOND,C.POUPAT,P.POTIER
Literature Reference Citation J.NAT.PROD.,53,894(1990)
Literature Reference DOI 10.1021/np50070a017
Molecular Weight 448.513 g/mol
Solvent CDCl3
Source File Reference UWED16896