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Carbamic acid, N-(2-butyl)-N-octadecyl-, ethyl ester

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Carbamic acid, N-(2-butyl)-N-octadecyl-, ethyl ester
SpectraBase Compound ID JQkPVFz4ghI
InChI InChI=1S/C25H51NO2/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(24(4)6-2)25(27)28-7-3/h24H,5-23H2,1-4H3
InChIKey DWZYMEAFGNVOBQ-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 6tQEWmYS8Km
Name Carbamic acid, N-(2-butyl)-N-octadecyl-, ethyl 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/c1-5-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26(24(4)6-2)25(27)28-7-3/h24H,5-23H2,1-4H3
InChIKey DWZYMEAFGNVOBQ-UHFFFAOYSA-N
Molecular Weight 397.688 g/mol
SMILES C(N(CCCCCCCCCCCCCCCCCC)C(CC)C)(=O)OCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.867655