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(2R,3R,4R,8R,E)-8-Hydroxyundeca-6,10-diene-2,3,4-triyl triacetate
SpectraBase Compound ID 8nIFH1G827O
InChI InChI=1S/C17H26O7/c1-6-8-15(21)9-7-10-16(23-13(4)19)17(24-14(5)20)11(2)22-12(3)18/h6-7,9,11,15-17,21H,1,8,10H2,2-5H3/b9-7+/t11-,15-,16-,17-/m1/s1
InChIKey VOKCQJXNYLFTAV-RQFCIRASSA-N
Mol Weight 342.39 g/mol
Molecular Formula C17H26O7
Exact Mass 342.167853 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6jPHzkUXb9l
Name (2R,3R,4R,8R,E)-8-Hydroxyundeca-6,10-diene-2,3,4-triyl triacetate
Comments Computed using HOSE algorithm
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Exact Mass 342.167853170 u
Formula C17H26O7
InChI InChI=1S/C17H26O7/c1-6-8-15(21)9-7-10-16(23-13(4)19)17(24-14(5)20)11(2)22-12(3)18/h6-7,9,11,15-17,21H,1,8,10H2,2-5H3/b9-7+/t11-,15-,16-,17-/m1/s1
InChIKey VOKCQJXNYLFTAV-RQFCIRASSA-N
Molecular Weight 342.388 g/mol
SMILES [C@@]([C@](OC(=O)C)(C\C=C\[C@](O)(CC=C)[H])[H])([C@](OC(=O)C)(C)[H])(OC(=O)C)[H]