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N-(2-Cyclododecylideneethyl)-N-(2-cyclododecylethyl)amine

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

N-(2-Cyclododecylideneethyl)-N-(2-cyclododecylethyl)amine
SpectraBase Compound ID JW2Ehmi39KN
InChI InChI=1S/C28H53N/c1-3-7-11-15-19-27(20-16-12-8-4-1)23-25-29-26-24-28-21-17-13-9-5-2-6-10-14-18-22-28/h23,28-29H,1-22,24-26H2
InChIKey YTKKOGBGCKBRET-UHFFFAOYSA-N
Mol Weight 403.7 g/mol
Molecular Formula C28H53N
Exact Mass 403.417801 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9nSurLTthGf
Name N-(2-Cyclododecylideneethyl)-N-(2-cyclododecylethyl)amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.417800711 u
Formula C28H53N
InChI InChI=1S/C28H53N/c1-3-7-11-15-19-27(20-16-12-8-4-1)23-25-29-26-24-28-21-17-13-9-5-2-6-10-14-18-22-28/h23,28-29H,1-22,24-26H2
InChIKey YTKKOGBGCKBRET-UHFFFAOYSA-N
Molecular Weight 403.739 g/mol
SMILES C1(=CCNCCC2CCCCCCCCCCC2)CCCCCCCCCCC1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926557