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6',12-Dichlorisoplagiochin D (Bazzanin J)
SpectraBase Compound ID EBpGDSndJXr
InChI InChI=1S/C28H22Cl2O4/c29-22-9-7-17-5-1-16-3-8-19(25(32)12-16)20-14-23(30)26(33)13-18(20)6-2-15-4-10-24(31)21(11-15)27(17)28(22)34/h3-4,7-14,31-34H,1-2,5-6H2
InChIKey VYMBGGJWHGWXFI-UHFFFAOYSA-N
Mol Weight 493.39 g/mol
Molecular Formula C28H22Cl2O4
Exact Mass 492.089515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3qTdTFl3Kov
Name 6',12-Dichlorisoplagiochin D (Bazzanin J)
Comments Less than 3 mono-isotopic peaks
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Formula C28H22Cl2O4
InChI InChI=1S/C28H22Cl2O4/c29-22-9-7-17-5-1-16-3-8-19(25(32)12-16)20-14-23(30)26(33)13-18(20)6-2-15-4-10-24(31)21(11-15)27(17)28(22)34/h3-4,7-14,31-34H,1-2,5-6H2
InChIKey VYMBGGJWHGWXFI-UHFFFAOYSA-N
Molecular Weight 493.386 g/mol
SMILES Oc1cc2CCc3ccc(c(c3-c3c(ccc(CCc4c(-c1cc2)cc(c(c4)O)Cl)c3)O)O)Cl
SPLASH splash10-0006-0000900000-11fd862617e974a06d04
Source of Spectrum CV-2002-2511-13
Wiley ID 1610482