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2-(4-Methoxyphenyl)pentanenitrile
SpectraBase Compound ID 3DmPmrrUsHV
InChI InChI=1S/C12H15NO/c1-3-4-11(9-13)10-5-7-12(14-2)8-6-10/h5-8,11H,3-4H2,1-2H3
InChIKey QYEXJHNAPHRQOD-UHFFFAOYSA-N
Mol Weight 189.26 g/mol
Molecular Formula C12H15NO
Exact Mass 189.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AjvgogSuiyR
Name 2-(4-Methoxyphenyl)pentanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO
InChI InChI=1S/C12H15NO/c1-3-4-11(9-13)10-5-7-12(14-2)8-6-10/h5-8,11H,3-4H2,1-2H3
InChIKey QYEXJHNAPHRQOD-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol200194y
Molecular Weight 189.258 g/mol
SMILES c1c(ccc(C(CCC)C#N)c1)OC
SPLASH splash10-0002-0900000000-b83b8349192fffa5daf2
Source of Spectrum A1-13-1690/SMS14-4i
Wiley ID 1752936