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(5S/R,8S)-6-(But-3'-enyl)-8-acetoxybicyclo[3.3.0]oct-1-en-3-one
SpectraBase Compound ID IrokhWtTPEG
InChI InChI=1S/C14H18O3/c1-3-4-5-10-6-14(17-9(2)15)13-8-11(16)7-12(10)13/h3,8,10,12,14H,1,4-7H2,2H3/t10?,12?,14-/m0/s1
InChIKey LBYXLXFWNPGBMV-OVGLSYRBSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7ntIrEXDaGI
Name (5S/R,8S)-6-(But-3'-enyl)-8-acetoxybicyclo[3.3.0]oct-1-en-3-one
Alternate Name(s) (5R/S,8S)-6-(But-3'-enyl)-8-acetoxybicyclo[3.3.0]oct-1-en-3-one (1S)-3-(3-butenyl)-5-oxo-1,2,3,3a,4,5-hexahydro-1-pentalenyl acetate
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Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-3-4-5-10-6-14(17-9(2)15)13-8-11(16)7-12(10)13/h3,8,10,12,14H,1,4-7H2,2H3/t10?,12?,14-/m0/s1
InChIKey LBYXLXFWNPGBMV-OVGLSYRBSA-N
Molecular Weight 234.295 g/mol
SMILES C=12C(C(CCC=C)C[C@@]2(OC(=O)C)[H])CC(C1)=O
SPLASH splash10-000x-6900000000-e80dfe6a84d6e0da24c4
Source of Spectrum H-79-474-12
Wiley ID 1236175