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3-(1-Hydroxy-1-methylethyl)benzonitrile
SpectraBase Compound ID 5orueH5IlHZ
InChI InChI=1S/C10H11NO/c1-10(2,12)9-5-3-4-8(6-9)7-11/h3-6,12H,1-2H3
InChIKey MPCIWYWNQBXEGC-UHFFFAOYSA-N
Mol Weight 161.2 g/mol
Molecular Formula C10H11NO
Exact Mass 161.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fPNohh35BQ
Name 3-(1-Hydroxy-1-methylethyl)benzonitrile
Alternate Name(s) 3-(2-hydroxypropan-2-yl)benzonitrile 3-(2-oxidanylpropan-2-yl)benzenecarbonitrile
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Formula C10H11NO
InChI InChI=1S/C10H11NO/c1-10(2,12)9-5-3-4-8(6-9)7-11/h3-6,12H,1-2H3
InChIKey MPCIWYWNQBXEGC-UHFFFAOYSA-N
Molecular Weight 161.204 g/mol
SMILES OC(c1cc(C#N)ccc1)(C)C
SPLASH splash10-0007-9700000000-715cf816f6a5e3717c00
Wiley ID 1483376