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(3aS,4S,5aR,8aR)-7-Methylene-1-oxo-octahydro-pentaleno[1,6a-c]furan-4-carboxylic acid methyl ester
SpectraBase Compound ID 4romX1Zx9ob
InChI InChI=1S/C13H16O4/c1-7-3-8-4-9(11(14)16-2)10-6-17-12(15)13(8,10)5-7/h8-10H,1,3-6H2,2H3/t8-,9-,10-,13?/m0/s1
InChIKey JTSYLQWSKLWOPE-LXXJUSEXSA-N
Mol Weight 236.27 g/mol
Molecular Formula C13H16O4
Exact Mass 236.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuuisPpnIpt
Name (3aS,4S,5aR,8aR)-7-Methylene-1-oxo-octahydro-pentaleno[1,6a-c]furan-4-carboxylic acid methyl ester
Alternate Name(s) Methyl (3aS,4S,5aR,8aR)-7-methylene-1-oxooctahydropentaleno[1,6a-c]furan-4-carboxylate Methyl (4.alpha.)-octahydro-7-methylene-1-oxo-1H-pentaleno[1,6-c]furan-4-carboxylate
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Formula C13H16O4
InChI InChI=1S/C13H16O4/c1-7-3-8-4-9(11(14)16-2)10-6-17-12(15)13(8,10)5-7/h8-10H,1,3-6H2,2H3/t8-,9-,10-,13?/m0/s1
InChIKey JTSYLQWSKLWOPE-LXXJUSEXSA-N
Molecular Weight 236.267 g/mol
SMILES C123[C@]([C@@](C(=O)OC)(C[C@@]3(CC(C1)=C)[H])[H])(COC2=O)[H]
SPLASH splash10-014i-5900000000-619452372e6f3f5242ba
Source of Spectrum U1-1998-280-6
Wiley ID 750913