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4,5-Di-n-propyl-7-butyl-2,2-(oxoethylenedioxy)bicyclo[2.2.2]oct-5-en-3-one
SpectraBase Compound ID 9Ktq945SQbi
InChI InChI=1S/C20H30O4/c1-4-7-9-14-12-19(10-6-3)15(8-5-2)11-16(14)20(18(19)22)23-13-17(21)24-20/h11,14,16H,4-10,12-13H2,1-3H3/t14-,16-,19-,20?/m0/s1
InChIKey LZUFDXKYQVJCEF-WXHHGMJOSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0SbOyeHuUV
Name 4,5-Di-n-propyl-7-butyl-2,2-(oxoethylenedioxy)bicyclo[2.2.2]oct-5-en-3-one
Alternate Name(s) 7-Butyl-4,5-dipropylspiro[bicyclo[2.2.2]octane-2,2'-[1,3]dioxolan]-5-ene-3,5'-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-4-7-9-14-12-19(10-6-3)15(8-5-2)11-16(14)20(18(19)22)23-13-17(21)24-20/h11,14,16H,4-10,12-13H2,1-3H3/t14-,16-,19-,20?/m0/s1
InChIKey LZUFDXKYQVJCEF-WXHHGMJOSA-N
Molecular Weight 334.456 g/mol
SMILES C12(C([C@@]3(CCC)C[C@@]([C@@]2(C=C3CCC)[H])(CCCC)[H])=O)OC(=O)CO1
SPLASH splash10-0bti-1493000000-f29d48a4b69f105cc664
Source of Spectrum QA-31-266-5
Wiley ID 860896