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MALABARICONE-B
SpectraBase Compound ID F7SkZtGy46B
InChI InChI=1S/C21H26O4/c22-17-14-12-16(13-15-17)8-5-3-1-2-4-6-9-18(23)21-19(24)10-7-11-20(21)25/h7,10-15,22,24-25H,1-6,8-9H2
InChIKey KOAPDMKKECXPHX-UHFFFAOYSA-N
Mol Weight 342.44 g/mol
Molecular Formula C21H26O4
Exact Mass 342.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 659yyYKOAaB
Name 1-(2,6-Dihydroxyphenyl)-9-(4-hydroxyphenyl)nonan-1-one
Alternate Name(s) 1-(2,6-dihydroxyphenyl)-9-(4-hydroxyphenyl)-1-nonanone 1-[2,6-bis(oxidanyl)phenyl]-9-(4-hydroxyphenyl)nonan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C21H26O4
InChI InChI=1S/C21H26O4/c22-17-14-12-16(13-15-17)8-5-3-1-2-4-6-9-18(23)21-19(24)10-7-11-20(21)25/h7,10-15,22,24-25H,1-6,8-9H2
InChIKey KOAPDMKKECXPHX-UHFFFAOYSA-N
Molecular Weight 342.435 g/mol
SMILES Oc1ccc(CCCCCCCCC(c2c(cccc2O)O)=O)cc1
SPLASH splash10-000i-0904000000-8962543a3db258b94bff
Source of Spectrum E1-39-22-1
Wiley ID 1518646