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Carbonic acid, monoamide, N-propyl-N-dodecyl-, butyl ester
SpectraBase Compound ID BXFEiebQxM0
InChI InChI=1S/C20H41NO2/c1-4-7-9-10-11-12-13-14-15-16-18-21(17-6-3)20(22)23-19-8-5-2/h4-19H2,1-3H3
InChIKey MLFBFIHJDQMDGR-UHFFFAOYSA-N
Mol Weight 327.6 g/mol
Molecular Formula C20H41NO2
Exact Mass 327.31373 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID E8xsETx0lAl
Name Carbonic acid, monoamide, N-propyl-N-dodecyl-, butyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.313729562 u
Formula C20H41NO2
InChI InChI=1S/C20H41NO2/c1-4-7-9-10-11-12-13-14-15-16-18-21(17-6-3)20(22)23-19-8-5-2/h4-19H2,1-3H3
InChIKey MLFBFIHJDQMDGR-UHFFFAOYSA-N
Molecular Weight 327.553 g/mol
SMILES C(N(CCC)CCCCCCCCCCCC)(=O)OCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.875533