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Carbonic acid, monoamide, N-benzyl-N-undecyl-, allyl ester

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

Carbonic acid, monoamide, N-benzyl-N-undecyl-, allyl ester
SpectraBase Compound ID 5WjloGARry9
InChI InChI=1S/C22H35NO2/c1-3-5-6-7-8-9-10-11-15-18-23(22(24)25-19-4-2)20-21-16-13-12-14-17-21/h4,12-14,16-17H,2-3,5-11,15,18-20H2,1H3
InChIKey SNKWMDQABCJCPY-UHFFFAOYSA-N
Mol Weight 345.5 g/mol
Molecular Formula C22H35NO2
Exact Mass 345.266779 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 9gToTVJ7Lh1
Name Carbonic acid, monoamide, N-benzyl-N-undecyl-, allyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.266779369 u
Formula C22H35NO2
InChI InChI=1S/C22H35NO2/c1-3-5-6-7-8-9-10-11-15-18-23(22(24)25-19-4-2)20-21-16-13-12-14-17-21/h4,12-14,16-17H,2-3,5-11,15,18-20H2,1H3
InChIKey SNKWMDQABCJCPY-UHFFFAOYSA-N
Molecular Weight 345.527 g/mol
SMILES C=CCOC(=O)N(CCCCCCCCCCC)CC1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915682