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4-(1-Methyl-piperidin-4-yl)-benzonitrile

View entire compound with spectra: 1 MS (GC)

4-(1-Methyl-piperidin-4-yl)-benzonitrile
SpectraBase Compound ID DQ1FEK85SG6
InChI InChI=1S/C13H16N2/c1-15-8-6-13(7-9-15)12-4-2-11(10-14)3-5-12/h2-5,13H,6-9H2,1H3
InChIKey HWXNXYAUOPBIRP-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C13H16N2
Exact Mass 200.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4aKrAVHKdKZ
Name 4-(1-Methyl-piperidin-4-yl)-benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2
InChI InChI=1S/C13H16N2/c1-15-8-6-13(7-9-15)12-4-2-11(10-14)3-5-12/h2-5,13H,6-9H2,1H3
InChIKey HWXNXYAUOPBIRP-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol702499h
Molecular Weight 200.285 g/mol
SMILES c1c(ccc(c1)C#N)C1CCN(CC1)C
SPLASH splash10-0f6t-5980000000-d9aba77a92ecafbd4716
Source of Spectrum A1-9-5529/SMS12-3n
Synonyms 4-(1-Methylpiperidin-4-yl)benzonitrile 4-(1-Methyl-4-piperidinyl)benzonitrile 4-(1-Methylpiperidin-4-yl)benzenecarbonitrile
Wiley ID 1758909