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2,3-(Cyclohexylidenedioxy)-5-(2',2'-cyclohexylideneyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl (R)-bicyclo[2.2.1]hept-5-en-2-carboxylate

View entire compound with spectra: 1 MS (GC)

2,3-(Cyclohexylidenedioxy)-5-(2',2'-cyclohexylideneyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl (R)-bicyclo[2.2.1]hept-5-en-2-carboxylate
SpectraBase Compound ID 4RjSazR5ifq
InChI InChI=1S/C26H36O7/c27-23(18-14-16-7-8-17(18)13-16)29-21-20(19-15-28-25(31-19)9-3-1-4-10-25)30-24-22(21)32-26(33-24)11-5-2-6-12-26/h7-8,16-22,24H,1-6,9-15H2/t16-,17+,18-,19?,20?,21?,22?,24?/m1/s1
InChIKey SGNCGWZYAAJWHY-OCOMYURVSA-N
Mol Weight 460.6 g/mol
Molecular Formula C26H36O7
Exact Mass 460.246103 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ef1Ms9x9U8
Name 2,3-(Cyclohexylidenedioxy)-5-(2',2'-cyclohexylideneyl-1',3'-dioxalan-4'-yl)tetrahydrofuran-4-yl (R)-bicyclo[2.2.1]hept-5-en-2-carboxylate
Comments Removed - expert review: contamination (chloroform))
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O7
InChI InChI=1S/C26H36O7/c27-23(18-14-16-7-8-17(18)13-16)29-21-20(19-15-28-25(31-19)9-3-1-4-10-25)30-24-22(21)32-26(33-24)11-5-2-6-12-26/h7-8,16-22,24H,1-6,9-15H2/t16-,17+,18-,19?,20?,21?,22?,24?/m1/s1
InChIKey SGNCGWZYAAJWHY-OCOMYURVSA-N
Molecular Weight 460.567 g/mol
SMILES C12C(C(C3OC4(CCCCC4)OC3)OC1OC1(O2)CCCCC1)OC([C@]1([C@]2(C=C[C@@](C1)(C2)[H])[H])[H])=O
SPLASH splash10-001i-9000000000-cbb1ec65134324057677
Source of Spectrum QC-9-2679-7
Wiley ID 870642