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2-Methyl-3-phenyl-3-buten-2-ol
SpectraBase Compound ID F7jPQAN5byu
InChI InChI=1S/C11H14O/c1-9(11(2,3)12)10-7-5-4-6-8-10/h4-8,12H,1H2,2-3H3
InChIKey IBHTVMUPFNHFLY-UHFFFAOYSA-N
Mol Weight 162.23 g/mol
Molecular Formula C11H14O
Exact Mass 162.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C7PKDst8Baq
Name 2-Methyl-3-phenyl-3-buten-2-ol
CAS Registry Number 25982-72-3
Comments Note: The molecular formula of the structure shown is C11H14O - which differs from the formula reported for the mass spectrum (C20H39DO2)
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Formula C20H39DO2
InChI InChI=1S/C11H14O/c1-9(11(2,3)12)10-7-5-4-6-8-10/h4-8,12H,1H2,2-3H3
InChIKey IBHTVMUPFNHFLY-UHFFFAOYSA-N
Molecular Weight 162.232 g/mol
SMILES OC(C(c1ccccc1)=C)(C)C
SPLASH splash10-05g3-9200000000-028fb52895cdbf067fbc
Synonyms 2-Methyl-3-phenyl-but-3-en-2-ol Benzeneethanol, .alpha.,.alpha.-dimethyl-.beta.-methylene-
Wiley ID 1485852