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.alpha.-(Trifluoromethyl)benzyl alcohol, 2-methylpropyl ether
SpectraBase Compound ID 4PpCisWl12Q
InChI InChI=1S/C12H15F3O/c1-9(2)8-16-11(12(13,14)15)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3
InChIKey LBRPKNNUPGEJKM-UHFFFAOYSA-N
Mol Weight 232.25 g/mol
Molecular Formula C12H15F3O
Exact Mass 232.1075 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DzMdVmACejS
Name .alpha.-(Trifluoromethyl)benzyl alcohol, 2-methylpropyl ether
Comments Computed using HOSE algorithm
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Exact Mass 232.107499591 u
Formula C12H15F3O
InChI InChI=1S/C12H15F3O/c1-9(2)8-16-11(12(13,14)15)10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3
InChIKey LBRPKNNUPGEJKM-UHFFFAOYSA-N
Molecular Weight 232.246 g/mol
SMILES C1=CC=CC=C1C(OCC(C)C)C(F)(F)F