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CALOLONGIC_ACID

View entire compound with spectra: 1 NMR

CALOLONGIC_ACID
SpectraBase Compound ID 4mfOYe6tTBB
InChI InChI=1S/C22H28O6/c1-6-7-13(10-15(23)24)16-19(26)17-18(25)11(2)12(3)27-20(17)14-8-9-22(4,5)28-21(14)16/h8-9,11-13,26H,6-7,10H2,1-5H3,(H,23,24)/t11-,12-,13?/m1/s1
InChIKey MXFUJXIOAUPXPT-ZNRZSNADSA-N
Mol Weight 388.46 g/mol
Molecular Formula C22H28O6
Exact Mass 388.188589 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Bo5Upnr0lN
Name CALOLONGIC_ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O6
InChI InChI=1S/C22H28O6/c1-6-7-13(10-15(23)24)16-19(26)17-18(25)11(2)12(3)27-20(17)14-8-9-22(4,5)28-21(14)16/h8-9,11-13,26H,6-7,10H2,1-5H3,(H,23,24)/t11-,12-,13?/m1/s1
InChIKey MXFUJXIOAUPXPT-ZNRZSNADSA-N
Literature Reference Author A.HAY,D.GUILET,C.MOREL,G.LARCHER,D.MACHEREL,A.LE_RAY,M.LITAU DON,P.RICHOMME
Literature Reference Citation PLANTA.MED.,69,1130(2003)
Literature Reference DOI 10.1055/s-2003-818004
Molecular Weight 388.461 g/mol
Solvent CDCl3
Source File Reference UIAP2094