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2-Oxo-14-(3',4'-methylenedioxyphenyl)-trans-13-tetradecene
SpectraBase Compound ID 1eLrWEpsbNA
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/h11,13-16H,2-10,12,17H2,1H3/b13-11+
InChIKey XSCQBXUNBGFDEK-ACCUITESSA-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 Ap65NnscJOa
Name 2-Oxo-14-(3',4'-methylenedioxyphenyl)-trans-13-tetradecene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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/h11,13-16H,2-10,12,17H2,1H3/b13-11+
InChIKey XSCQBXUNBGFDEK-ACCUITESSA-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)\C=C\CCCCCCCCCCC(C)=O
SPLASH splash10-001i-0904000000-0dff3f569fcb21e20080
Source of Spectrum G4-67-1967-5
Wiley ID 1881614