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Tris(3,5,5-trimethylhexyl)amine

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

Tris(3,5,5-trimethylhexyl)amine
SpectraBase Compound ID Fk3pDaRSImr
InChI InChI=1S/C27H57N/c1-22(19-25(4,5)6)13-16-28(17-14-23(2)20-26(7,8)9)18-15-24(3)21-27(10,11)12/h22-24H,13-21H2,1-12H3
InChIKey FXWPURVBESCOOX-UHFFFAOYSA-N
Mol Weight 395.8 g/mol
Molecular Formula C27H57N
Exact Mass 395.449101 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2NP8hiwu9B0
Name Tris(3,5,5-trimethylhexyl)amine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.449100839 u
Formula C27H57N
InChI InChI=1S/C27H57N/c1-22(19-25(4,5)6)13-16-28(17-14-23(2)20-26(7,8)9)18-15-24(3)21-27(10,11)12/h22-24H,13-21H2,1-12H3
InChIKey FXWPURVBESCOOX-UHFFFAOYSA-N
Molecular Weight 395.760 g/mol
SMILES C(N(CCC(CC(C)(C)C)C)CCC(CC(C)(C)C)C)CC(CC(C)(C)C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.810982