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(6E)-Heptadeca-6,16-diene-1,2,4-triol, 3ac

View entire compound with spectra: 1 NMR

(6E)-Heptadeca-6,16-diene-1,2,4-triol, 3ac
SpectraBase Compound ID LODQ81ZscwM
InChI InChI=1S/C23H38O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-22(28-20(3)25)17-23(29-21(4)26)18-27-19(2)24/h5,14-15,22-23H,1,6-13,16-18H2,2-4H3/b15-14+
InChIKey VFWSHNWHLZYAFR-CCEZHUSRSA-N
Mol Weight 410.6 g/mol
Molecular Formula C23H38O6
Exact Mass 410.266839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CTNaCb3lf3Q
Name (6E)-Heptadeca-6,16-diene-1,2,4-triol, 3ac
Comments Computed using HOSE algorithm
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Exact Mass 410.266838938 u
Formula C23H38O6
InChI InChI=1S/C23H38O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-22(28-20(3)25)17-23(29-21(4)26)18-27-19(2)24/h5,14-15,22-23H,1,6-13,16-18H2,2-4H3/b15-14+
InChIKey VFWSHNWHLZYAFR-CCEZHUSRSA-N
Molecular Weight 410.551 g/mol
SMILES CC(=O)OCC(OC(C)=O)CC(OC(C)=O)C\C=C\CCCCCCCCC=C