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N-(1-Phenethyl-4-piperidyl)-2,2-dimethylpropionate

View entire compound with spectra: 1 NMR, 1 FTIR, and 3 MS (GC)

N-(1-Phenethyl-4-piperidyl)-2,2-dimethylpropionate
SpectraBase Compound ID GcwCxFbhoKM
InChI InChI=1S/C18H27NO2/c1-18(2,3)17(20)21-16-10-13-19(14-11-16)12-9-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3
InChIKey XJNOZZQSKFANSH-UHFFFAOYSA-N
Mol Weight 289.42 g/mol
Molecular Formula C18H27NO2
Exact Mass 289.204179 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IJIGbyv9PtT
Name N-(1-Phenethyl-4-piperidyl)-2,2-dimethylpropionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.204179111 u
Formula C18H27NO2
InChI InChI=1S/C18H27NO2/c1-18(2,3)17(20)21-16-10-13-19(14-11-16)12-9-15-7-5-4-6-8-15/h4-8,16H,9-14H2,1-3H3
InChIKey XJNOZZQSKFANSH-UHFFFAOYSA-N
SMILES C(C(OC1CCN(CCC=2C=CC=CC2)CC1)=O)(C)(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.869108