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1-(6-Ethyl-o-tolyl)-3-propylurea

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

1-(6-Ethyl-o-tolyl)-3-propylurea
SpectraBase Compound ID 1V432AGkRG2
InChI InChI=1S/C13H20N2O/c1-4-9-14-13(16)15-12-10(3)7-6-8-11(12)5-2/h6-8H,4-5,9H2,1-3H3,(H2,14,15,16)
InChIKey YIVDGASJTDTCAG-UHFFFAOYSA-N
Mol Weight 220.32 g/mol
Molecular Formula C13H20N2O
Exact Mass 220.157563 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID HKKsWnUNQrT
Name 1-(6-Ethyl-o-tolyl)-3-propylurea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 220.157563271 u
Formula C13H20N2O
InChI InChI=1S/C13H20N2O/c1-4-9-14-13(16)15-12-10(3)7-6-8-11(12)5-2/h6-8H,4-5,9H2,1-3H3,(H2,14,15,16)
InChIKey YIVDGASJTDTCAG-UHFFFAOYSA-N
Molecular Weight 220.316 g/mol
SMILES N(C1=C(C=CC=C1CC)C)C(NCCC)=O
Spectrum/Structure Validation Score (Raman) 0.990601