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2,6,10-Dodecatrien-1-al, 12-(acetoxy)-2,6,10-trimethyl-, (E,E,E)-

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2,6,10-Dodecatrien-1-al, 12-(acetoxy)-2,6,10-trimethyl-, (E,E,E)-
SpectraBase Compound ID Ej0B6dBqLOa
InChI InChI=1S/C17H26O3/c1-14(8-6-10-16(3)13-18)7-5-9-15(2)11-12-20-17(4)19/h7,10-11,13H,5-6,8-9,12H2,1-4H3/b14-7+,15-11+,16-10+
InChIKey LRIUGFZTYQJCLE-JDDBBKIWSA-N
Mol Weight 278.39 g/mol
Molecular Formula C17H26O3
Exact Mass 278.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LINVfSAvgP0
Name 2,6,10-Dodecatrien-1-al, 12-(acetoxy)-2,6,10-trimethyl-, (E,E,E)-
Comments Computed using HOSE algorithm
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Exact Mass 278.188194694 u
Formula C17H26O3
InChI InChI=1S/C17H26O3/c1-14(8-6-10-16(3)13-18)7-5-9-15(2)11-12-20-17(4)19/h7,10-11,13H,5-6,8-9,12H2,1-4H3/b14-7+,15-11+,16-10+
InChIKey LRIUGFZTYQJCLE-JDDBBKIWSA-N
Molecular Weight 278.392 g/mol
SMILES C(=O)\C(=C\CC\C(=C\CC\C(=C\COC(C)=O)C)C)C