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a-(3-chloro-4-hydroxyphenyl)-a-phenoxy-a-phenylacetonitrile
SpectraBase Compound ID BtQWdrFXAM8
InChI InChI=1S/C20H14ClNO2/c21-18-13-16(11-12-19(18)23)20(14-22,15-7-3-1-4-8-15)24-17-9-5-2-6-10-17/h1-13,23H
InChIKey UMNRCAPZJZIJQL-UHFFFAOYSA-N
Mol Weight 335.79 g/mol
Molecular Formula C20H14ClNO2
Exact Mass 335.071306 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPvTCRk0v6Y
Name a-(3-chloro-4-hydroxyphenyl)-a-phenoxy-a-phenylacetonitrile
Alternate Name(s) 2-(3-chloro-4-hydroxyphenyl)-2-phenoxy-2-phenylacetonitrile 2-(3-chloranyl-4-oxidanyl-phenyl)-2-phenoxy-2-phenyl-ethanenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C20H14ClNO2
InChI InChI=1S/C20H14ClNO2/c21-18-13-16(11-12-19(18)23)20(14-22,15-7-3-1-4-8-15)24-17-9-5-2-6-10-17/h1-13,23H
InChIKey UMNRCAPZJZIJQL-UHFFFAOYSA-N
Molecular Weight 335.790 g/mol
SMILES Oc1ccc(C(C#N)(Oc2ccccc2)c2ccccc2)cc1Cl
SPLASH splash10-0a4i-0009000000-15f64afff4502d456ec3
Source of Spectrum U1-2011-6891-2b
Wiley ID 1702904