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CARDINALIC_ACID

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

CARDINALIC_ACID
SpectraBase Compound ID 57DU0ZrVrgZ
InChI InChI=1S/C17H12O8/c1-5-3-6-10(14(20)9(5)17(23)24)15(21)11-7(12(6)18)4-8(25-2)13(19)16(11)22/h3-4,19-20,22H,1-2H3,(H,23,24)
InChIKey OTSOZQYFRAQJFG-UHFFFAOYSA-N
Mol Weight 344.27 g/mol
Molecular Formula C17H12O8
Exact Mass 344.053217 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7mlv9UdREFC
Name CARDINALIC_ACID
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H12O8
InChI InChI=1S/C17H12O8/c1-5-3-6-10(14(20)9(5)17(23)24)15(21)11-7(12(6)18)4-8(25-2)13(19)16(11)22/h3-4,19-20,22H,1-2H3,(H,23,24)
InChIKey OTSOZQYFRAQJFG-UHFFFAOYSA-N
Literature Reference Author M.GILL,P.M.MORGAN,J.M.WHITE,J.YU
Literature Reference Citation AUSTR.J.CHEM.,51,213(1998)
Literature Reference DOI 10.1071/C97154
Molecular Weight 344.277 g/mol
Solvent CDCl3
Source File Reference UWKP301