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Glycine, 2-cyclohexyl-N-ethoxycarbonyl-, pentadecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

Glycine, 2-cyclohexyl-N-ethoxycarbonyl-, pentadecyl ester
SpectraBase Compound ID 2bg3NBdx5nE
InChI InChI=1S/C26H49NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-22-31-25(28)24(27-26(29)30-4-2)23-20-17-16-18-21-23/h23-24H,3-22H2,1-2H3,(H,27,29)
InChIKey MTOXGDBELOKYLL-UHFFFAOYSA-N
Mol Weight 439.7 g/mol
Molecular Formula C26H49NO4
Exact Mass 439.366159 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 87PItY7SMc3
Name Glycine, 2-cyclohexyl-N-ethoxycarbonyl-, pentadecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 439.366159058 u
Formula C26H49NO4
InChI InChI=1S/C26H49NO4/c1-3-5-6-7-8-9-10-11-12-13-14-15-19-22-31-25(28)24(27-26(29)30-4-2)23-20-17-16-18-21-23/h23-24H,3-22H2,1-2H3,(H,27,29)
InChIKey MTOXGDBELOKYLL-UHFFFAOYSA-N
Molecular Weight 439.681 g/mol
SMILES C1CC(CCC1)C(NC(=O)OCC)C(OCCCCCCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.846568