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Acetic acid 2-ethynyl-adamantan-2-yl ester
SpectraBase Compound ID JcLrX5kgby3
InChI InChI=1S/C14H18O2/c1-3-14(16-9(2)15)12-5-10-4-11(7-12)8-13(14)6-10/h1,10-13H,4-8H2,2H3/t10-,11+,12-,13+,14?
InChIKey CDBKXUCTXRMDEU-VEDUHTKKSA-N
Mol Weight 218.3 g/mol
Molecular Formula C14H18O2
Exact Mass 218.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xsZKcsCYvn
Name Acetic acid 2-ethynyl-adamantan-2-yl ester
Alternate Name(s) (2-ethynyl-2-adamantyl) acetate (2-ethynyl-2-adamantyl) ethanoate Acetic acid (2-ethynyl-2-adamantyl) ester
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Formula C14H18O2
InChI InChI=1S/C14H18O2/c1-3-14(16-9(2)15)12-5-10-4-11(7-12)8-13(14)6-10/h1,10-13H,4-8H2,2H3/t10-,11+,12-,13+,14?
InChIKey CDBKXUCTXRMDEU-VEDUHTKKSA-N
Molecular Weight 218.296 g/mol
SMILES C1([C@]2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])[H])(C#C)OC(=O)C
SPLASH splash10-054o-7900000000-92514f0c4433815014ae
Wiley ID 1463663