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12,10'-Dichloroisoplagiochin C
SpectraBase Compound ID 7NIAgvMI5J0
InChI InChI=1S/C28H20Cl2O4/c29-23-14-22-19-13-24(30)28(34)11-17(19)5-1-15-3-7-25(31)20(9-15)21-10-16(4-8-26(21)32)2-6-18(23)12-27(22)33/h2-4,6-14,31-34H,1,5H2/b6-2-
InChIKey SAIWRJCEKYTPJT-KXFIGUGUSA-N
Mol Weight 491.37 g/mol
Molecular Formula C28H20Cl2O4
Exact Mass 490.073865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9bncDc4XQeA
Name 12,10'-Dichloroisoplagiochin C
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H20Cl2O4
InChI InChI=1S/C28H20Cl2O4/c29-23-14-22-19-13-24(30)28(34)11-17(19)5-1-15-3-7-25(31)20(9-15)21-10-16(4-8-26(21)32)2-6-18(23)12-27(22)33/h2-4,6-14,31-34H,1,5H2/b6-2-
InChIKey SAIWRJCEKYTPJT-KXFIGUGUSA-N
Molecular Weight 491.370 g/mol
SMILES Oc1cc2c(cc1-c1c(CCc3cc(-c4c(ccc(\C=C/2)c4)O)c(cc3)O)cc(c(c1)Cl)O)Cl
SPLASH splash10-0006-0010900000-50924906c96ae4ad2e05
Source of Spectrum F-56-3156-5
Wiley ID 856953