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Ethyl 7-.alpha.-hydroxy-6.beta.-[2.alpha.-hydroxy-(E)-1-octenyl]-3-oxo-2-oxabicyclo[3.3.0]octane-4-ylidenemethoxy)acetate
SpectraBase Compound ID JK5sR9Di3b1
InChI InChI=1S/C20H30O7/c1-3-5-6-7-13(21)8-9-14-16(22)10-17-19(14)15(20(24)27-17)11-25-12-18(23)26-4-2/h8-9,11,13-14,16-17,19,21-22H,3-7,10,12H2,1-2H3/b9-8+,15-11+/t13?,14?,16-,17+,19+/m1/s1
InChIKey PKFXTVNJCHIPMZ-CMNMLISJSA-N
Mol Weight 382.45 g/mol
Molecular Formula C20H30O7
Exact Mass 382.199153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HGT5GgZcrIf
Name Ethyl 7-.alpha.-hydroxy-6.beta.-[2.alpha.-hydroxy-(E)-1-octenyl]-3-oxo-2-oxabicyclo[3.3.0]octane-4-ylidenemethoxy)acetate
Alternate Name(s) Ethyl {[(E)-((3aS,5R,6aS)-5-hydroxy-4-[(1E)-3-hydroxy-1-octenyl]-2-oxotetrahydro-2H-cyclopenta[b]furan-3(3aH)-ylidene)methyl]oxy}acetate
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Formula C20H30O7
InChI InChI=1S/C20H30O7/c1-3-5-6-7-13(21)8-9-14-16(22)10-17-19(14)15(20(24)27-17)11-25-12-18(23)26-4-2/h8-9,11,13-14,16-17,19,21-22H,3-7,10,12H2,1-2H3/b9-8+,15-11+/t13?,14?,16-,17+,19+/m1/s1
InChIKey PKFXTVNJCHIPMZ-CMNMLISJSA-N
Molecular Weight 382.453 g/mol
SMILES OC(\C=C\C1[C@@](C[C@@]2(OC(\C([C@]12[H])=C/OCC(=O)OCC)=O)[H])(O)[H])CCCCC
SPLASH splash10-01vn-0049000000-9eb72250ea7576abc12f
Source of Spectrum O1-33-1272-8
Wiley ID 819263