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Benzeneacetonitrile, 4-(4-piperidyl)-

View entire compound with spectra: 1 FTIR

Benzeneacetonitrile, 4-(4-piperidyl)-
SpectraBase Compound ID 85i6BvMAWnJ
InChI InChI=1S/C13H16N2/c14-8-5-11-1-3-12(4-2-11)13-6-9-15-10-7-13/h1-4,13,15H,5-7,9-10H2
InChIKey QRBVBQAQJXQYON-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C13H16N2
Exact Mass 200.131349 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DU8KjqcPYai
Name Benzeneacetonitrile, 4-(4-piperidyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 200.131348523 u
Formula C13H16N2
InChI InChI=1S/C13H16N2/c14-8-5-11-1-3-12(4-2-11)13-6-9-15-10-7-13/h1-4,13,15H,5-7,9-10H2
InChIKey QRBVBQAQJXQYON-UHFFFAOYSA-N
Molecular Weight 200.285 g/mol
SMILES C1(=CC=C(C=C1)C1CCNCC1)CC#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.919352