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ethyl 2,3,7-trimethylocta-2,6-dienoate
SpectraBase Compound ID 330t0BvHkKd
InChI InChI=1S/C13H22O2/c1-6-15-13(14)12(5)11(4)9-7-8-10(2)3/h8H,6-7,9H2,1-5H3
InChIKey MDHZSKWEFABKKL-UHFFFAOYSA-N
Mol Weight 210.32 g/mol
Molecular Formula C13H22O2
Exact Mass 210.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AqS4myC3MAL
Name ethyl 2,3,7-trimethylocta-2,6-dienoate
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O2
InChI InChI=1S/C13H22O2/c1-6-15-13(14)12(5)11(4)9-7-8-10(2)3/h8H,6-7,9H2,1-5H3
InChIKey MDHZSKWEFABKKL-UHFFFAOYSA-N
Instrument Name MSD5975C
Ionization Type EI
Molecular Weight 210.317 g/mol
SMILES C(C)OC(C(=C(CCC=C(C)C)C)C)=O
SPLASH splash10-014l-9100000000-5f3cfe9f892843c5d46d
Sample Comments Major isomer, Mixture of E/Z (1.2:1)
Source of Spectrum WO2017097884A1
Wiley ID 1855413