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1-Benzyl-3-(6-ethyl-o-tolyl)urea

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

1-Benzyl-3-(6-ethyl-o-tolyl)urea
SpectraBase Compound ID 7hNqaKSGpoU
InChI InChI=1S/C17H20N2O/c1-3-15-11-7-8-13(2)16(15)19-17(20)18-12-14-9-5-4-6-10-14/h4-11H,3,12H2,1-2H3,(H2,18,19,20)
InChIKey KXTYNICVQKMOOX-UHFFFAOYSA-N
Mol Weight 268.36 g/mol
Molecular Formula C17H20N2O
Exact Mass 268.157563 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 5kkxSCecyXS
Name 1-Benzyl-3-(6-ethyl-o-tolyl)urea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.157563271 u
Formula C17H20N2O
InChI InChI=1S/C17H20N2O/c1-3-15-11-7-8-13(2)16(15)19-17(20)18-12-14-9-5-4-6-10-14/h4-11H,3,12H2,1-2H3,(H2,18,19,20)
InChIKey KXTYNICVQKMOOX-UHFFFAOYSA-N
Molecular Weight 268.360 g/mol
SMILES N(C1=C(C=CC=C1CC)C)C(NCC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Raman) 0.901881