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2-(3-Butynyl)-2-methylcyclohexanone 1,2-ethandiyl acetal
SpectraBase Compound ID EK3EohpTuab
InChI InChI=1S/C13H20O2/c1-3-4-7-12(2)8-5-6-9-13(12)14-10-11-15-13/h1H,4-11H2,2H3
InChIKey HTSGFLDKDHOFAP-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EMCebHHVJuh
Name 2-(3-Butynyl)-2-methylcyclohexanone 1,2-ethandiyl acetal
Comments Less than 3 mono-isotopic peaks
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Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-3-4-7-12(2)8-5-6-9-13(12)14-10-11-15-13/h1H,4-11H2,2H3
InChIKey HTSGFLDKDHOFAP-UHFFFAOYSA-N
Molecular Weight 208.301 g/mol
SMILES C12(C(CCC#C)(C)CCCC2)OCCO1
SPLASH splash10-0002-9000000000-228097e23bd6f6c34e9c
Source of Spectrum SO-1977-608-3
Wiley ID 1537029