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4-(2,2-difluoro-1-hydroxy-ethyl)benzonitrile
SpectraBase Compound ID 2k1FIQNwVEk
InChI InChI=1S/C9H7F2NO/c10-9(11)8(13)7-3-1-6(5-12)2-4-7/h1-4,8-9,13H
InChIKey BPJTYNGDSPVAPA-UHFFFAOYSA-N
Mol Weight 183.16 g/mol
Molecular Formula C9H7F2NO
Exact Mass 183.04957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22lHQtL94po
Name 4-(2,2-difluoro-1-hydroxy-ethyl)benzonitrile
Alternate Name(s) 4-[2,2-bis(fluoranyl)-1-oxidanyl-ethyl]benzenecarbonitrile
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Formula C9H7F2NO
InChI InChI=1S/C9H7F2NO/c10-9(11)8(13)7-3-1-6(5-12)2-4-7/h1-4,8-9,13H
InChIKey BPJTYNGDSPVAPA-UHFFFAOYSA-N
Molecular Weight 183.158 g/mol
SMILES OC(C(F)F)c1ccc(cc1)C#N
SPLASH splash10-0f89-1900000000-a82acd20e1668e7a3308
Source of Spectrum F-70-9043-4
Wiley ID 1597651