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3-Benzhydryloxy-5-methoxy-2-nitrophenylacetonitrile
SpectraBase Compound ID HNgS8OfkaA2
InChI InChI=1S/C22H18N2O4/c1-27-19-14-18(12-13-23)21(24(25)26)20(15-19)28-22(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,14-15,22H,12H2,1H3
InChIKey ZVAOFUTZSKPIBI-UHFFFAOYSA-N
Mol Weight 374.4 g/mol
Molecular Formula C22H18N2O4
Exact Mass 374.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FvwURvJANJv
Name 3-Benzhydryloxy-5-methoxy-2-nitrophenylacetonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C22H18N2O4
InChI InChI=1S/C22H18N2O4/c1-27-19-14-18(12-13-23)21(24(25)26)20(15-19)28-22(16-8-4-2-5-9-16)17-10-6-3-7-11-17/h2-11,14-15,22H,12H2,1H3
InChIKey ZVAOFUTZSKPIBI-UHFFFAOYSA-N
Molecular Weight 374.396 g/mol
SMILES c1(N(=O)=O)c(OC(c2ccccc2)c2ccccc2)cc(cc1CC#N)OC
SPLASH splash10-0a4i-0009000000-3d2c615d6765c6c60620
Source of Spectrum KC-0-2563-6
Wiley ID 780003