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Pentacyclo-octadecatriene-11,13-dione
SpectraBase Compound ID KQHA586Tp7P
InChI InChI=1S/C16H14O2/c17-11-8-16-6-4-10-2-1-9-3-5-15(11,7-12(16)18)13(9)14(10)16/h1-2H,3-8H2/t15-,16-/m0/s1
InChIKey XLFNKSYBWIHNSS-HOTGVXAUSA-N
Mol Weight 238.29 g/mol
Molecular Formula C16H14O2
Exact Mass 238.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3a3OSlgfkAk
Name Pentacyclo-octadecatriene-11,13-dione
Alternate Name(s) (1R,4R)-pentacyclo[5.5.2.2(1,4).0(4,14).0(10,13)]hexadeca-7(14),8,10(13)-triene-2,15-dione
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Formula C16H14O2
InChI InChI=1S/C16H14O2/c17-11-8-16-6-4-10-2-1-9-3-5-15(11,7-12(16)18)13(9)14(10)16/h1-2H,3-8H2/t15-,16-/m0/s1
InChIKey XLFNKSYBWIHNSS-HOTGVXAUSA-N
Molecular Weight 238.286 g/mol
SMILES [C@]123c4c5c(CC[C@@]5(C(C3)=O)CC1=O)ccc4CC2
SPLASH splash10-00kb-0910000000-2b201f077e26e342a851
Source of Spectrum U1-2001-4605-18
Wiley ID 815218