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2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitril

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitril
SpectraBase Compound ID BacDIHXOyti
InChI InChI=1S/C15H20N2O2/c1-18-14-7-6-12(10-15(14)19-2)13(11-16)17-8-4-3-5-9-17/h6-7,10,13H,3-5,8-9H2,1-2H3
InChIKey FQELSXKYURXBIN-UHFFFAOYSA-N
Mol Weight 260.34 g/mol
Molecular Formula C15H20N2O2
Exact Mass 260.152478 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 8MfSblSJ3Ub
Name 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitril
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 260.152477890 u
Formula C15H20N2O2
InChI InChI=1S/C15H20N2O2/c1-18-14-7-6-12(10-15(14)19-2)13(11-16)17-8-4-3-5-9-17/h6-7,10,13H,3-5,8-9H2,1-2H3
InChIKey FQELSXKYURXBIN-UHFFFAOYSA-N
Molecular Weight 260.337 g/mol
SMILES C(N1CCCCC1)(C1=CC(OC)=C(C=C1)OC)C#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.942941