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2,3-(Cyclohexylidenedioxy)-5-(2',2'-cyclohexylideneyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl acrylate isomer
SpectraBase Compound ID HGbcODQQ7Ff
InChI InChI=1S/C21H30O7/c1-2-15(22)24-17-16(14-13-23-20(26-14)9-5-3-6-10-20)25-19-18(17)27-21(28-19)11-7-4-8-12-21/h2,14,16-19H,1,3-13H2/t14?,16-,17+,18-,19-/m1/s1
InChIKey UCOGLFDUQVPIJM-MSEHENTLSA-N
Mol Weight 394.46 g/mol
Molecular Formula C21H30O7
Exact Mass 394.199153 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DyYCjGGpPC8
Name 2,3-(Cyclohexylidenedioxy)-5-(2',2'-cyclohexylideneyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl acrylate isomer
Alternate Name(s) (2R,3R,4S,5R)-2,3-(Cyclohexylidenedioxy)-5-(2',2'-cyclohexylideneyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl acrylate isomer
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Formula C21H30O7
InChI InChI=1S/C21H30O7/c1-2-15(22)24-17-16(14-13-23-20(26-14)9-5-3-6-10-20)25-19-18(17)27-21(28-19)11-7-4-8-12-21/h2,14,16-19H,1,3-13H2/t14?,16-,17+,18-,19-/m1/s1
InChIKey UCOGLFDUQVPIJM-MSEHENTLSA-N
Molecular Weight 394.464 g/mol
SMILES [C@]12([C@](O[C@@]([C@@]2(OC(C=C)=O)[H])(C2OC3(CCCCC3)OC2)[H])(OC2(O1)CCCCC2)[H])[H]
SPLASH splash10-0pbc-9207000000-7ba072cd18f9a028c33f
Source of Spectrum QC-9-2677-6
Wiley ID 870645