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(R)-2-(4-methoxyphenyl)-4-oxo-4-(p-tolyl)butanenitrile

View entire compound with spectra: 1 MS (GC)

(R)-2-(4-methoxyphenyl)-4-oxo-4-(p-tolyl)butanenitrile
SpectraBase Compound ID 4NxrJ2D7DuG
InChI InChI=1S/C18H17NO2/c1-13-3-5-15(6-4-13)18(20)11-16(12-19)14-7-9-17(21-2)10-8-14/h3-10,16H,11H2,1-2H3/t16-/m0/s1
InChIKey SZYLTDBEYKKHTE-INIZCTEOSA-N
Mol Weight 279.34 g/mol
Molecular Formula C18H17NO2
Exact Mass 279.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B381GOpD9ZQ
Name (R)-2-(4-methoxyphenyl)-4-oxo-4-(p-tolyl)butanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO2
InChI InChI=1S/C18H17NO2/c1-13-3-5-15(6-4-13)18(20)11-16(12-19)14-7-9-17(21-2)10-8-14/h3-10,16H,11H2,1-2H3/t16-/m0/s1
InChIKey SZYLTDBEYKKHTE-INIZCTEOSA-N
Literature Reference DOI 10.1039/c4gc00386a
Molecular Weight 279.339 g/mol
SMILES [C@](CC(=O)c1ccc(cc1)C)(c1ccc(cc1)OC)(C#N)[H]
SPLASH splash10-00kf-4920000000-fa54057d0c55c9fe06ec
Source of Spectrum GCH-16-3454/SM4-2h
Wiley ID 1755383