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2-Ethynyl-1,7,7-trimethyl-norbornan-2-ol
SpectraBase Compound ID EJLmec9iJ9o
InChI InChI=1S/C12H18O/c1-5-12(13)8-9-6-7-11(12,4)10(9,2)3/h1,9,13H,6-8H2,2-4H3/t9-,11-,12?/m0/s1
InChIKey AXIWZGXZGAUBSU-HFLPBZFISA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AN9D5v0pxCM
Name 2-ethynyl-1,7,7-trimethyl-norbornan-2-ol
Alternate Name(s) 2-ethynyl-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol 3-ethynyl-4,7,7-trimethyl-3-bicyclo[2.2.1]heptanol 3-ethynyl-4,7,7-trimethyl-bicyclo[2.2.1]heptan-3-ol
Comments Less than 3 mono-isotopic peaks
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Formula C12H18O
InChI InChI=1S/C12H18O/c1-5-12(13)8-9-6-7-11(12,4)10(9,2)3/h1,9,13H,6-8H2,2-4H3/t9-,11-,12?/m0/s1
InChIKey AXIWZGXZGAUBSU-HFLPBZFISA-N
Molecular Weight 178.275 g/mol
SMILES OC1([C@@]2(C([C@@](CC2)(C1)[H])(C)C)C)C#C
SPLASH splash10-0002-9000000000-809e6116d56dee54936a
Source of Spectrum O1-31-502-7
Wiley ID 818807