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2-Oxo-18-(3',4'-methylenedioxyphenyl)octadecane
SpectraBase Compound ID 7LxI8bdllDK
InChI InChI=1S/C25H40O3/c1-22(26)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-23-18-19-24-25(20-23)28-21-27-24/h18-20H,2-17,21H2,1H3
InChIKey SVTYLQARFHCNGC-UHFFFAOYSA-N
Mol Weight 388.6 g/mol
Molecular Formula C25H40O3
Exact Mass 388.297745 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 10R27VfbJA
Name 2-Oxo-18-(3',4'-methylenedioxyphenyl)octadecane
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40O3
InChI InChI=1S/C25H40O3/c1-22(26)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-23-18-19-24-25(20-23)28-21-27-24/h18-20H,2-17,21H2,1H3
InChIKey SVTYLQARFHCNGC-UHFFFAOYSA-N
Instrument Name JEOL SX 102
Ionization Type EI
Literature Reference DOI 10.1021/np0401260
Molecular Weight 388.592 g/mol
Reported Formula C25H40O3
SMILES c12ccc(cc2OCO1)CCCCCCCCCCCCCCCCC(C)=O
SPLASH splash10-000i-0509000000-a661f5fecf99dce8a962
Source of Spectrum G4-67-1966-4
Wiley ID 1881613