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Carbamic acid, N-(2-butyl)-N-hexyl-, benzyl ester

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

Carbamic acid, N-(2-butyl)-N-hexyl-, benzyl ester
SpectraBase Compound ID G4qCJtP4sEn
InChI InChI=1S/C18H29NO2/c1-4-6-7-11-14-19(16(3)5-2)18(20)21-15-17-12-9-8-10-13-17/h8-10,12-13,16H,4-7,11,14-15H2,1-3H3
InChIKey WASFHSKHXYRVFI-UHFFFAOYSA-N
Mol Weight 291.44 g/mol
Molecular Formula C18H29NO2
Exact Mass 291.219829 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GcDGGwwoqXu
Name Carbamic acid, N-(2-butyl)-N-hexyl-, benzyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 291.219829176 u
Formula C18H29NO2
InChI InChI=1S/C18H29NO2/c1-4-6-7-11-14-19(16(3)5-2)18(20)21-15-17-12-9-8-10-13-17/h8-10,12-13,16H,4-7,11,14-15H2,1-3H3
InChIKey WASFHSKHXYRVFI-UHFFFAOYSA-N
SMILES C(N(CCCCCC)C(CC)C)(=O)OCC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.880483