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4-(hexylidenel)bicyclo[4.3.0]-2-oxanonan-3-one isomer
SpectraBase Compound ID G3oa6EpPNXv
InChI InChI=1S/C14H22O2/c1-2-3-4-5-9-12-11-8-6-7-10-13(11)16-14(12)15/h9,11,13H,2-8,10H2,1H3/b12-9-/t11?,13-/m1/s1
InChIKey VOHGVHBWLSVOOI-CWTMSTGFSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CiFm152pXbb
Name 4-(hexylidenel)bicyclo[4.3.0]-2-oxanonan-3-one isomer
Alternate Name(s) (3Z)-3-hexylidenehexahydrocyclopenta[b]pyran-2(3H)-one (R)-3-Hex-(Z)-ylidene-hexahydro-benzofuran-2-one
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Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-2-3-4-5-9-12-11-8-6-7-10-13(11)16-14(12)15/h9,11,13H,2-8,10H2,1H3/b12-9-/t11?,13-/m1/s1
InChIKey VOHGVHBWLSVOOI-CWTMSTGFSA-N
Molecular Weight 222.328 g/mol
SMILES C1(\C(C2CCCC[C@]2(O1)[H])=C/CCCCC)=O
SPLASH splash10-014i-9000000000-dcfe573399fb5ddd194c
Source of Spectrum J-57-4703-42
Wiley ID 1222975