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2-butyl-1,8-bis(oxidanyl)-10H-anthracen-9-one
SpectraBase Compound ID 8KLgPbI800Q
InChI InChI=1S/C18H18O3/c1-2-3-5-11-8-9-13-10-12-6-4-7-14(19)15(12)18(21)16(13)17(11)20/h4,6-9,19-20H,2-3,5,10H2,1H3
InChIKey DLRVAHCNVVWDMI-UHFFFAOYSA-N
Mol Weight 282.34 g/mol
Molecular Formula C18H18O3
Exact Mass 282.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BSW4hf0665w
Name 2-butyl-1,8-bis(oxidanyl)-10H-anthracen-9-one
Alternate Name(s) 2-butyl-1,8-dihydroxy-10H-anthracen-9-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H18O3
InChI InChI=1S/C18H18O3/c1-2-3-5-11-8-9-13-10-12-6-4-7-14(19)15(12)18(21)16(13)17(11)20/h4,6-9,19-20H,2-3,5,10H2,1H3
InChIKey DLRVAHCNVVWDMI-UHFFFAOYSA-N
Molecular Weight 282.339 g/mol
SMILES Oc1cccc2Cc3ccc(c(c3C(c12)=O)O)CCCC
SPLASH splash10-001r-0090000000-69a51fe13e4776bffeb4
Source of Spectrum F2-40-3778-5
Wiley ID 1599443