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(1S,2R,4R,5S)-endo-2,4-Dimethyl-1-pivaloyloxy-8-oxabicyclo[3.2.1]oct-6-en-3-one
SpectraBase Compound ID 8O3L92yF8ps
InChI InChI=1S/C14H20O4/c1-8-10-6-7-14(17-10,9(2)11(8)15)18-12(16)13(3,4)5/h6-10H,1-5H3/t8-,9-,10+,14+/m1/s1
InChIKey PHCCCODWURQRFQ-RBQUTUCGSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LM3yMtc2HCi
Name (1S,2R,4R,5S)-endo-2,4-Dimethyl-1-pivaloyloxy-8-oxabicyclo[3.2.1]oct-6-en-3-one
Alternate Name(s) (1S,2R,4R,5S)-2,4-dimethyl-3-oxo-8-oxabicyclo[3.2.1]oct-6-en-1-yl pivalate cis-endo-2,4-Dimethyl-1-pivaloyloxy-8-oxabicyclo[3.2.1]oct-6-en-3-one 2,2-Dimethylpropanoic acid [(1S,2R,4R,5S)-2,4-dimethyl-3-oxo-8-oxabicyclo[3.2.1]oct-6-en-5-yl] ester [(1S,2R,4R,5S)-2,4-dimethyl-3-oxo-8-oxabicyclo[3.2.1]oct-6-en-5-yl] 2,2-dimethylpropanoate [(1S,2R,4R,5S)-2,4-dimethyl-3-oxidanylidene-8-oxabicyclo[3.2.1]oct-6-en-5-yl] 2,2-dimethylpropanoate
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Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-8-10-6-7-14(17-10,9(2)11(8)15)18-12(16)13(3,4)5/h6-10H,1-5H3/t8-,9-,10+,14+/m1/s1
InChIKey PHCCCODWURQRFQ-RBQUTUCGSA-N
Molecular Weight 252.310 g/mol
SMILES [C@@]12([C@@](C(=O)[C@@]([C@@](O2)(C=C1)[H])(C)[H])(C)[H])OC(C(C)(C)C)=O
SPLASH splash10-014i-0900000000-642294d22091a05f5e95
Source of Spectrum F-53-11680-31
Wiley ID 803427