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(2R,9R,10R)-6-Methyl-7-tert-butoxy-4-acetoxybicyclo[4.4.0]dec-1-en-3-one isomer
SpectraBase Compound ID BeN5MMNhFHe
InChI InChI=1S/C17H26O4/c1-11(18)20-14-10-17(5)12(9-13(14)19)7-6-8-15(17)21-16(2,3)4/h9,14-15H,6-8,10H2,1-5H3/t14-,15-,17-/m1/s1
InChIKey UGEJTKRTLHNNGN-BFYDXBDKSA-N
Mol Weight 294.39 g/mol
Molecular Formula C17H26O4
Exact Mass 294.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9emNJ0SHdEq
Name (2R,9R,10R)-6-Methyl-7-tert-butoxy-4-acetoxybicyclo[4.4.0]dec-1-en-3-one isomer
Alternate Name(s) Acetic acid (2R,8R,8aR)-8-tert-butoxy-8a-methyl-3-oxo-1,2,3,5,6,7,8,8a-octahydro-naphthalen-2-yl ester
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Formula C17H26O4
InChI InChI=1S/C17H26O4/c1-11(18)20-14-10-17(5)12(9-13(14)19)7-6-8-15(17)21-16(2,3)4/h9,14-15H,6-8,10H2,1-5H3/t14-,15-,17-/m1/s1
InChIKey UGEJTKRTLHNNGN-BFYDXBDKSA-N
Molecular Weight 294.391 g/mol
SMILES [C@]12(C(=CC([C@@](C2)(OC(=O)C)[H])=O)CCC[C@]1(OC(C)(C)C)[H])C
SPLASH splash10-00ai-1900000000-8845f35f4df526375d3e
Source of Spectrum F-50-8423-22
Wiley ID 1298265