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2-(1',1'-Bis(ethoxycarbonyl)ethyl)-1-undecen-4-one
SpectraBase Compound ID 9DpuS6h60XW
InChI InChI=1S/C19H32O5/c1-6-9-10-11-12-13-16(20)14-15(4)19(5,17(21)23-7-2)18(22)24-8-3/h4,6-14H2,1-3,5H3
InChIKey CAMUAOHPSQAKFB-UHFFFAOYSA-N
Mol Weight 340.5 g/mol
Molecular Formula C19H32O5
Exact Mass 340.224974 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJCuZcftvCt
Name 2-(1',1'-Bis(ethoxycarbonyl)ethyl)-1-undecen-4-one
Alternate Name(s) diethyl 2-methyl-2-[1-(2-oxononyl)vinyl]malonate
Comments Less than 3 mono-isotopic peaks
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Formula C19H32O5
InChI InChI=1S/C19H32O5/c1-6-9-10-11-12-13-16(20)14-15(4)19(5,17(21)23-7-2)18(22)24-8-3/h4,6-14H2,1-3,5H3
InChIKey CAMUAOHPSQAKFB-UHFFFAOYSA-N
Molecular Weight 340.460 g/mol
SMILES C(C(CC(=O)CCCCCCC)=C)(C(=O)OCC)(C(=O)OCC)C
SPLASH splash10-0a4i-9000000000-8c2cb1a214c8eb78604b
Source of Spectrum KC-61-4161-5
Wiley ID 1628865