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Carbonic acid, monoamide, N-(2-pentyl)-N-hexadecyl-, propyl ester

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

Carbonic acid, monoamide, N-(2-pentyl)-N-hexadecyl-, propyl ester
SpectraBase Compound ID 8vG3BAj9g8i
InChI InChI=1S/C25H51NO2/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-22-26(24(4)21-6-2)25(27)28-23-7-3/h24H,5-23H2,1-4H3
InChIKey VSAJUCNMMKWABF-UHFFFAOYSA-N
Mol Weight 397.7 g/mol
Molecular Formula C25H51NO2
Exact Mass 397.39198 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FYmwU4mJuae
Name Carbonic acid, monoamide, N-(2-pentyl)-N-hexadecyl-, propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 397.391979884 u
Formula C25H51NO2
InChI InChI=1S/C25H51NO2/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-22-26(24(4)21-6-2)25(27)28-23-7-3/h24H,5-23H2,1-4H3
InChIKey VSAJUCNMMKWABF-UHFFFAOYSA-N
Molecular Weight 397.688 g/mol
SMILES CCCC(C)N(C(OCCC)=O)CCCCCCCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.880431