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(E)-1-(Piperidin-1-yl)octadec-2-en-1-one

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

(E)-1-(Piperidin-1-yl)octadec-2-en-1-one
SpectraBase Compound ID I0UPZDpoN4T
InChI InChI=1S/C23H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23(25)24-21-18-16-19-22-24/h17,20H,2-16,18-19,21-22H2,1H3/b20-17+
InChIKey PPSREOHNKFETQU-LVZFUZTISA-N
Mol Weight 349.6 g/mol
Molecular Formula C23H43NO
Exact Mass 349.334465 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6Aq7KDWW7rd
Name (E)-1-(Piperidin-1-yl)octadec-2-en-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.334465008 u
Formula C23H43NO
InChI InChI=1S/C23H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-23(25)24-21-18-16-19-22-24/h17,20H,2-16,18-19,21-22H2,1H3/b20-17+
InChIKey PPSREOHNKFETQU-LVZFUZTISA-N
Molecular Weight 349.603 g/mol
SMILES C(\C=C\CCCCCCCCCCCCCCC)(=O)N1CCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.941214