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BAZZANIN-P;2,10,12,6',10'-PENTACHLOROISOPLAGIOCHIN-C
SpectraBase Compound ID IQ6qDCFGwYy
InChI InChI=1S/C28H17Cl5O4/c29-20-9-12-1-3-14-4-6-16(27(36)23(14)32)17-11-22(31)28(37)24(33)15(17)5-2-13-8-19(18(7-12)25(20)34)26(35)21(30)10-13/h1,3-4,6-11,34-37H,2,5H2/b3-1-
InChIKey SCOUMBPIYBHEHN-IWQZZHSRSA-N
Mol Weight 594.7 g/mol
Molecular Formula C28H17Cl5O4
Exact Mass 591.956948 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 40X8OxfuRqD
Name BAZZANIN-P;2,10,12,6',10'-PENTACHLOROISOPLAGIOCHIN-C
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H17Cl5O4
InChI InChI=1S/C28H17Cl5O4/c29-20-9-12-1-3-14-4-6-16(27(36)23(14)32)17-11-22(31)28(37)24(33)15(17)5-2-13-8-19(18(7-12)25(20)34)26(35)21(30)10-13/h1,3-4,6-11,34-37H,2,5H2/b3-1-
InChIKey SCOUMBPIYBHEHN-IWQZZHSRSA-N
Literature Reference Author J.M.SCHER,J.ZAPP,A.SCHMIDT,H.BECKER
Literature Reference Citation PHYTOCHEM.,64,791(2003)
Literature Reference DOI 10.1016/S0031-9422(03)00382-0
Molecular Weight 594.706 g/mol
Solvent CDCl3
Source File Reference UWKP5743