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Cyclohexanecarboxamide, N-(2-pentyl)-N-octyl-
SpectraBase Compound ID 5DNam1W0vFr
InChI InChI=1S/C20H39NO/c1-4-6-7-8-9-13-17-21(18(3)14-5-2)20(22)19-15-11-10-12-16-19/h18-19H,4-17H2,1-3H3
InChIKey IXPYMELOVAXRTD-UHFFFAOYSA-N
Mol Weight 309.5 g/mol
Molecular Formula C20H39NO
Exact Mass 309.303165 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9as3GM6Gx8i
Name Cyclohexanecarboxamide, N-(2-pentyl)-N-octyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.303164879 u
Formula C20H39NO
InChI InChI=1S/C20H39NO/c1-4-6-7-8-9-13-17-21(18(3)14-5-2)20(22)19-15-11-10-12-16-19/h18-19H,4-17H2,1-3H3
InChIKey IXPYMELOVAXRTD-UHFFFAOYSA-N
Molecular Weight 309.538 g/mol
SMILES C(N(C(CCC)C)C(C1CCCCC1)=O)CCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.901583