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7-[2',4'-Diacetoxyundecyl]- (perhydro)bipyran-1-one
SpectraBase Compound ID CShc2zM9u6c
InChI InChI=1S/C22H36O7/c1-4-5-6-7-8-9-17(26-15(2)23)10-18(27-16(3)24)11-19-12-20-13-21(28-19)14-22(25)29-20/h17-21H,4-14H2,1-3H3/t17-,18-,19+,20+,21-/m1/s1
InChIKey FVDITMBYDPRLGG-CRSSMBPESA-N
Mol Weight 412.5 g/mol
Molecular Formula C22H36O7
Exact Mass 412.246103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6E7GaSgA1sp
Name 7-[2',4'-Diacetoxyundecyl]- (perhydro)bipyran-1-one
Alternate Name(s) Diacetyl-polyrhacitide A
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Formula C22H36O7
InChI InChI=1S/C22H36O7/c1-4-5-6-7-8-9-17(26-15(2)23)10-18(27-16(3)24)11-19-12-20-13-21(28-19)14-22(25)29-20/h17-21H,4-14H2,1-3H3/t17-,18-,19+,20+,21-/m1/s1
InChIKey FVDITMBYDPRLGG-CRSSMBPESA-N
Molecular Weight 412.523 g/mol
SMILES C1(O[C@@]2(C[C@](C1)(O[C@](C2)(C[C@](OC(=O)C)(C[C@](OC(=O)C)(CCCCCCC)[H])[H])[H])[H])[H])=O
SPLASH splash10-0006-0941000000-24a5252a10337f9d26f6
Source of Spectrum G4-71-726-1a
Wiley ID 1694924