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2-Oxo-14-(3',4'-methylenedioxyphenyl)-trans-3-tetradecene
SpectraBase Compound ID 1WS3amvO3IZ
InChI InChI=1S/C21H30O3/c1-18(22)12-10-8-6-4-2-3-5-7-9-11-13-19-14-15-20-21(16-19)24-17-23-20/h10,12,14-16H,2-9,11,13,17H2,1H3/b12-10+
InChIKey HYOOYGBSEUETML-ZRDIBKRKSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7UWgnW6Rc0z
Name 2-Oxo-14-(3',4'-methylenedioxyphenyl)-trans-3-tetradecene
Appearance Colorless oil
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Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-18(22)12-10-8-6-4-2-3-5-7-9-11-13-19-14-15-20-21(16-19)24-17-23-20/h10,12,14-16H,2-9,11,13,17H2,1H3/b12-10+
InChIKey HYOOYGBSEUETML-ZRDIBKRKSA-N
Instrument Name JEOL SX 102
Ionization Type EI
Literature Reference DOI 10.1021/np0401260
Molecular Weight 330.468 g/mol
Reported Formula C21H30O3
SMILES c12ccc(cc2OCO1)CCCCCCCCCC\C=C\C(C)=O
SPLASH splash10-0019-1905000000-42f8679cbc13b8cb6437
Source of Spectrum G4-67-1967-12
Wiley ID 1881608