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(2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl decanoate

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(2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl decanoate
SpectraBase Compound ID HdTVnm9fYlF
InChI InChI=1S/C25H44O2/c1-6-7-8-9-10-11-12-19-25(26)27-21-20-24(5)18-14-17-23(4)16-13-15-22(2)3/h15,17,20H,6-14,16,18-19,21H2,1-5H3/b23-17+,24-20+
InChIKey ZSPZCKNQANJUIH-KSTRTYLUSA-N
Mol Weight 376.6 g/mol
Molecular Formula C25H44O2
Exact Mass 376.334131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LU41PkXefPx
Name (2E,6E)-3,7,11-Trimethyldodeca-2,6,10-trien-1-yl decanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 376.334130655 u
Formula C25H44O2
InChI InChI=1S/C25H44O2/c1-6-7-8-9-10-11-12-19-25(26)27-21-20-24(5)18-14-17-23(4)16-13-15-22(2)3/h15,17,20H,6-14,16,18-19,21H2,1-5H3/b23-17+,24-20+
InChIKey ZSPZCKNQANJUIH-KSTRTYLUSA-N
Molecular Weight 376.625 g/mol
SMILES C(CCCCCCCCC)(=O)OC\C=C\(CC\C=C\(CCC=C(C)C)C)C