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1,1-Diisopropyl-3-(2,3-xylyl)urea

View entire compound with spectra: 3 NMR, 1 FTIR, and 1 Raman

1,1-Diisopropyl-3-(2,3-xylyl)urea
SpectraBase Compound ID 89NBMyBmw8y
InChI InChI=1S/C15H24N2O/c1-10(2)17(11(3)4)15(18)16-14-9-7-8-12(5)13(14)6/h7-11H,1-6H3,(H,16,18)
InChIKey SQNMPOIJPJGWPC-UHFFFAOYSA-N
Mol Weight 248.37 g/mol
Molecular Formula C15H24N2O
Exact Mass 248.188863 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID C1sl26ynXj7
Name 1,1-Diisopropyl-3-(2,3-xylyl)urea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.188863400 u
Formula C15H24N2O
InChI InChI=1S/C15H24N2O/c1-10(2)17(11(3)4)15(18)16-14-9-7-8-12(5)13(14)6/h7-11H,1-6H3,(H,16,18)
InChIKey SQNMPOIJPJGWPC-UHFFFAOYSA-N
Molecular Weight 248.370 g/mol
SMILES N(C1=CC=CC(=C1C)C)C(N(C(C)C)C(C)C)=O
Spectrum/Structure Validation Score (Raman) 0.953077