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Carbonic acid, monoamide, N-propyl-N-undecyl-, but-2-yn-1-yl ester

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Carbonic acid, monoamide, N-propyl-N-undecyl-, but-2-yn-1-yl ester
SpectraBase Compound ID Ej7T6WGLN91
InChI InChI=1S/C19H35NO2/c1-4-7-9-10-11-12-13-14-15-17-20(16-6-3)19(21)22-18-8-5-2/h4,6-7,9-18H2,1-3H3
InChIKey IKHOHMDHRKDPRS-UHFFFAOYSA-N
Mol Weight 309.5 g/mol
Molecular Formula C19H35NO2
Exact Mass 309.266779 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9Y9fB40ebJ8
Name Carbonic acid, monoamide, N-propyl-N-undecyl-, but-2-yn-1-yl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 309.266779369 u
Formula C19H35NO2
InChI InChI=1S/C19H35NO2/c1-4-7-9-10-11-12-13-14-15-17-20(16-6-3)19(21)22-18-8-5-2/h4,6-7,9-18H2,1-3H3
InChIKey IKHOHMDHRKDPRS-UHFFFAOYSA-N
SMILES C(=O)(OCC#CC)N(CCC)CCCCCCCCCCC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.87072