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2-Heptyl-3-methylene-4-(ethoxycarbonyl)-5-phenyl-2,3-dihydroylfuran
SpectraBase Compound ID 3hxkBkGI50X
InChI InChI=1S/C21H28O3/c1-5-7-9-12-15(3)19-16(4)18(21(22)23-6-2)20(24-19)17-13-10-8-11-14-17/h8,10-11,13-15,19H,4-7,9,12H2,1-3H3
InChIKey XWOAMSKWFXULTJ-UHFFFAOYSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1H2jMvdgBBm
Name 2-Heptyl-3-methylene-4-(ethoxycarbonyl)-5-phenyl-2,3-dihydroylfuran
Comments Less than 3 mono-isotopic peaks
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Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-5-7-9-12-15(3)19-16(4)18(21(22)23-6-2)20(24-19)17-13-10-8-11-14-17/h8,10-11,13-15,19H,4-7,9,12H2,1-3H3
InChIKey XWOAMSKWFXULTJ-UHFFFAOYSA-N
Molecular Weight 328.452 g/mol
SMILES C1(=C(OC(C1=C)C(CCCCC)C)c1ccccc1)C(=O)OCC
SPLASH splash10-0006-0093000000-8dc8bbc57f5256629f7d
Source of Spectrum C-126-9659-5h
Wiley ID 1701382