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2,2-Dimethyl-1-phenyl-1-propanol
SpectraBase Compound ID 19c0jkKAwfK
InChI InChI=1S/C11H16O/c1-11(2,3)10(12)9-7-5-4-6-8-9/h4-8,10,12H,1-3H3
InChIKey YBVRFTBNIZWMSK-UHFFFAOYSA-N
Mol Weight 164.25 g/mol
Molecular Formula C11H16O
Exact Mass 164.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IpEHtNqgQvQ
Name 2,2-Dimethyl-1-phenyl-1-propanol (D3)
Alternate Name(s) Benzenemethanol, .alpha.-(1,1-dimethylethyl)- (D3) 2,2-Dimethyl-1-phenylpropan-1-ol (D3) tert-Butylphenylmethanol (D3)
CAS Registry Number 3835-64-1
Comments Note: The molecular formula of the structure shown is C11H16O - which differs from the formula reported for the mass spectrum (C11H13D3O)
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Formula C11H13D3O
InChI InChI=1S/C11H16O/c1-11(2,3)10(12)9-7-5-4-6-8-9/h4-8,10,12H,1-3H3
InChIKey YBVRFTBNIZWMSK-UHFFFAOYSA-N
Molecular Weight 164.248 g/mol
SMILES OC(c1ccccc1)C(C)(C)C
SPLASH splash10-056r-9400000000-c38bf3c3b6d4fb9b61ce
Wiley ID 1486050