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Urea, N,N-dimethyl-N'-benzyl-N'-undecyl-

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

Urea, N,N-dimethyl-N'-benzyl-N'-undecyl-
SpectraBase Compound ID vkrZpVW6Cx
InChI InChI=1S/C21H36N2O/c1-4-5-6-7-8-9-10-11-15-18-23(21(24)22(2)3)19-20-16-13-12-14-17-20/h12-14,16-17H,4-11,15,18-19H2,1-3H3
InChIKey PUFGHPPDPBXBID-UHFFFAOYSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H36N2O
Exact Mass 332.282764 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5KMUBJlJzwE
Name Urea, N,N-dimethyl-N'-benzyl-N'-undecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.282763786 u
Formula C21H36N2O
InChI InChI=1S/C21H36N2O/c1-4-5-6-7-8-9-10-11-15-18-23(21(24)22(2)3)19-20-16-13-12-14-17-20/h12-14,16-17H,4-11,15,18-19H2,1-3H3
InChIKey PUFGHPPDPBXBID-UHFFFAOYSA-N
Molecular Weight 332.532 g/mol
SMILES C(N(CCCCCCCCCCC)CC1=CC=CC=C1)(=O)N(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.874183