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N,N'-Didecylurea

View entire compound with spectra: 1 NMR, 1 FTIR, 1 Raman, and 2 MS (GC)

N,N'-Didecylurea
SpectraBase Compound ID H7wrJYpQCBg
InChI InChI=1S/C21H44N2O/c1-3-5-7-9-11-13-15-17-19-22-21(24)23-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3,(H2,22,23,24)
InChIKey PVJCTMOYESWMEF-UHFFFAOYSA-N
Mol Weight 340.6 g/mol
Molecular Formula C21H44N2O
Exact Mass 340.345364 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID C7SDKUlFTdn
Name N,N'-Didecylurea; urea, 1,3-didecyl-; urea, N,N'-didecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.345364044 u
Formula C21H44N2O
InChI InChI=1S/C21H44N2O/c1-3-5-7-9-11-13-15-17-19-22-21(24)23-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3,(H2,22,23,24)
InChIKey PVJCTMOYESWMEF-UHFFFAOYSA-N
Molecular Weight 340.596 g/mol
SMILES N(CCCCCCCCCC)C(NCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.995919