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Dicubyl ketone
SpectraBase Compound ID GXEM9gHfTQA
InChI InChI=1S/C17H14O/c18-15(16-9-3-1-4(9)11(16)5(1)10(3)16)17-12-6-2-7(12)14(17)8(2)13(6)17/h1-14H
InChIKey YXZQKPUBWFQMQZ-UHFFFAOYSA-N
Mol Weight 234.3 g/mol
Molecular Formula C17H14O
Exact Mass 234.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5AdznxGWaQo
Name Dicubyl ketone
Alternate Name(s) dipentacyclo[4.2.0.0(2,5).0(3,8).0(4,7)]oct-1-ylmethanone bis(1-cubanyl)methanone
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Formula C17H14O
InChI InChI=1S/C17H14O/c18-15(16-9-3-1-4(9)11(16)5(1)10(3)16)17-12-6-2-7(12)14(17)8(2)13(6)17/h1-14H
InChIKey YXZQKPUBWFQMQZ-UHFFFAOYSA-N
Molecular Weight 234.298 g/mol
SMILES C12(C(C34C5C6C4C4C6C5C34)=O)C3C4C2C2C4C3C12
SPLASH splash10-0fb9-4910000000-bec211fe9bd9b9614b3e
Source of Spectrum C-116-7595-14
Wiley ID 1236704