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(-)-(1R,6R,9S)-6-[(1'R)-1'-Hydroxy]ethyl]-11,12-dioxatricyclo[7.2.1.0(1,6)]dodecane

View entire compound with spectra: 2 MS (GC)

(-)-(1R,6R,9S)-6-[(1'R)-1'-Hydroxy]ethyl]-11,12-dioxatricyclo[7.2.1.0(1,6)]dodecane
SpectraBase Compound ID 2RTVIha3zfQ
InChI InChI=1S/C12H20O3/c1-9(13)11-5-2-3-6-12(11)14-8-10(15-12)4-7-11/h9-10,13H,2-8H2,1H3/t9-,10+,11-,12-/m1/s1
InChIKey SIMPOHDOLIYWEN-WRWGMCAJSA-N
Mol Weight 212.29 g/mol
Molecular Formula C12H20O3
Exact Mass 212.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KrMDkyXA9iH
Name 1-(1-Hydroxyethyl)-4,7-oxy-6-oxabicyclo[5.4.0]undecane isomer
Alternate Name(s) (1R,4S,7R)-1-((R)-1-Hydroxyethyl)-4,7-oxy-6-oxabicyclo[5.4.0]undecane isomer
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Formula C12H20O3
InChI InChI=1S/C12H20O3/c1-9(13)11-5-2-3-6-12(11)14-8-10(15-12)4-7-11/h9-10,13H,2-8H2,1H3/t9-,10+,11-,12-/m1/s1
InChIKey SIMPOHDOLIYWEN-WRWGMCAJSA-N
Molecular Weight 212.289 g/mol
SMILES O[C@@]([C@@]12[C@]3(O[C@@](CC2)(CO3)[H])CCCC1)(C)[H]
SPLASH splash10-014i-9600000000-6a5899f53b24a2b565b1
Source of Spectrum AT-32-5588-9
Wiley ID 836079