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methyl (E)-dodec-4-enoate
SpectraBase Compound ID 5XvvJnpbgjN
InChI InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h9-10H,3-8,11-12H2,1-2H3/b10-9+
InChIKey BONJSQHVLZLZCL-MDZDMXLPSA-N
Mol Weight 212.33 g/mol
Molecular Formula C13H24O2
Exact Mass 212.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21P0XEtPGq
Name methyl (E)-dodec-4-enoate
Carrier Gas Helium
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 212.177630011 u
Formula C13H24O2
GC Column HP-1 (50 m x 0.2 mm, film thickness 0.33 micrometer)
GC Oven Program Oven temp 250oC
InChI InChI=1S/C13H24O2/c1-3-4-5-6-7-8-9-10-11-12-13(14)15-2/h9-10H,3-8,11-12H2,1-2H3/b10-9+
InChIKey BONJSQHVLZLZCL-MDZDMXLPSA-N
Inlet Type Split (1:100)
Instrument Name Agilent 6890N-Agilent 5973N
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202200817
Molecular Weight 212.333 g/mol
Quality 1000
SMILES C(\C=C\CCC(=O)OC)CCCCCC
SPLASH splash10-0081-9500000000-bf3b7debc97131e0a7aa
Source of Spectrum CBD-20-SM52-5f (DOI: 10.1002/cbdv.202200817)
Wiley ID 1901381