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1-(Piperidin-1-yl)hexadecan-1-one

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

1-(Piperidin-1-yl)hexadecan-1-one
SpectraBase Compound ID IhvmQP4RG2V
InChI InChI=1S/C21H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21(23)22-19-16-14-17-20-22/h2-20H2,1H3
InChIKey SBWUACYNOBUPAH-UHFFFAOYSA-N
Mol Weight 323.6 g/mol
Molecular Formula C21H41NO
Exact Mass 323.318815 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Av3lMZjRnvk
Name 1-(Piperidin-1-yl)hexadecan-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.318814943 u
Formula C21H41NO
InChI InChI=1S/C21H41NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-18-21(23)22-19-16-14-17-20-22/h2-20H2,1H3
InChIKey SBWUACYNOBUPAH-UHFFFAOYSA-N
Molecular Weight 323.565 g/mol
SMILES C(CCCCCCCCCCCCCCC)(=O)N1CCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.893896