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2-(R,S)-(5-Methoxy-2-nitrophenyl)-3-(R)-methyl-3-phenylpropionitrile
SpectraBase Compound ID AQkUaei7kMh
InChI InChI=1S/C17H16N2O3/c1-12(13-6-4-3-5-7-13)16(11-18)15-10-14(22-2)8-9-17(15)19(20)21/h3-10,12,16H,1-2H3/t12-,16?/m0/s1
InChIKey ZFSAOKXLAWOTPU-HKALDPMFSA-N
Mol Weight 296.33 g/mol
Molecular Formula C17H16N2O3
Exact Mass 296.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F6tKThxzLZr
Name 2-(R,S)-(5-Methoxy-2-nitrophenyl)-3-(R)-methyl-3-phenylpropionitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16N2O3
InChI InChI=1S/C17H16N2O3/c1-12(13-6-4-3-5-7-13)16(11-18)15-10-14(22-2)8-9-17(15)19(20)21/h3-10,12,16H,1-2H3/t12-,16?/m0/s1
InChIKey ZFSAOKXLAWOTPU-HKALDPMFSA-N
Molecular Weight 296.326 g/mol
SMILES c1(N(=O)=O)c(C(C#N)[C@](c2ccccc2)(C)[H])cc(cc1)OC
SPLASH splash10-052e-0950000000-647befb83b0f05e9bdd6
Source of Spectrum H1-35-359-2
Synonyms (3R)-2-(5-methoxy-2-nitrophenyl)-3-phenylbutanenitrile
Wiley ID 754945