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2,7-Octadienoic acid, 6-(.alpha.-L-arabinopyranosyloxy)-2,6-dimethyl-, (2E,6S)-, o,o,o,o-tetramethyl
SpectraBase Compound ID CWXktXxqgf1
InChI InChI=1S/C19H32O7/c1-8-19(3,11-9-10-13(2)17(20)24-7)26-18-16(23-6)15(22-5)14(21-4)12-25-18/h8,10,14-16,18H,1,9,11-12H2,2-7H3/b13-10+/t14-,15-,16+,18-,19+/m0/s1
InChIKey JNBBYYUBEHKZIP-LGRKKXAASA-N
Mol Weight 372.5 g/mol
Molecular Formula C19H32O7
Exact Mass 372.214803 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4L9jEdms6C
Name 2,7-Octadienoic acid, 6-(.alpha.-L-arabinopyranosyloxy)-2,6-dimethyl-, (2E,6S)-, o,o,o,o-tetramethyl
Comments Computed using HOSE algorithm
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Exact Mass 372.214803363 u
Formula C19H32O7
InChI InChI=1S/C19H32O7/c1-8-19(3,11-9-10-13(2)17(20)24-7)26-18-16(23-6)15(22-5)14(21-4)12-25-18/h8,10,14-16,18H,1,9,11-12H2,2-7H3/b13-10+/t14-,15-,16+,18-,19+/m0/s1
InChIKey JNBBYYUBEHKZIP-LGRKKXAASA-N
Molecular Weight 372.458 g/mol
SMILES C(\C(C)=C\CC[C@](C=C)(C)O[C@]1([C@](OC)([C@@](OC)([C@@](OC)(CO1)[H])[H])[H])[H])(=O)OC