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Carbonic acid, monoamide, N-hexadecyl-, butyl ester

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

Carbonic acid, monoamide, N-hexadecyl-, butyl ester
SpectraBase Compound ID BgOypte7g5g
InChI InChI=1S/C21H43NO2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-22-21(23)24-20-6-4-2/h3-20H2,1-2H3,(H,22,23)
InChIKey IJUMJJQKKCUEHE-UHFFFAOYSA-N
Mol Weight 341.6 g/mol
Molecular Formula C21H43NO2
Exact Mass 341.32938 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3gdkFqqg9e3
Name Carbonic acid, monoamide, N-hexadecyl-, butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 341.329379627 u
Formula C21H43NO2
InChI InChI=1S/C21H43NO2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-22-21(23)24-20-6-4-2/h3-20H2,1-2H3,(H,22,23)
InChIKey IJUMJJQKKCUEHE-UHFFFAOYSA-N
Molecular Weight 341.580 g/mol
SMILES C(OCCCC)(=O)NCCCCCCCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.879729