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1-Isobutyl-3-(o-methoxyphenyl)urea

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

1-Isobutyl-3-(o-methoxyphenyl)urea
SpectraBase Compound ID 94eRGStEUG4
InChI InChI=1S/C12H18N2O2/c1-9(2)8-13-12(15)14-10-6-4-5-7-11(10)16-3/h4-7,9H,8H2,1-3H3,(H2,13,14,15)
InChIKey SQGQAYNVRPCQSP-UHFFFAOYSA-N
Mol Weight 222.29 g/mol
Molecular Formula C12H18N2O2
Exact Mass 222.136828 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 5gbWQ3aHhOz
Name 1-Isobutyl-3-(o-methoxyphenyl)urea
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.136827826 u
Formula C12H18N2O2
InChI InChI=1S/C12H18N2O2/c1-9(2)8-13-12(15)14-10-6-4-5-7-11(10)16-3/h4-7,9H,8H2,1-3H3,(H2,13,14,15)
InChIKey SQGQAYNVRPCQSP-UHFFFAOYSA-N
Molecular Weight 222.288 g/mol
SMILES N(C1=CC=CC=C1OC)C(NCC(C)C)=O
Spectrum/Structure Validation Score (Raman) 0.971528