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N-(1,3-benzodioxol-5-yl)-N'-cyclohexylurea
SpectraBase Compound ID 1VdOV6KK0XS
InChI InChI=1S/C14H18N2O3/c17-14(15-10-4-2-1-3-5-10)16-11-6-7-12-13(8-11)19-9-18-12/h6-8,10H,1-5,9H2,(H2,15,16,17)
InChIKey HLNZLRJBWHJAJM-UHFFFAOYSA-N
Mol Weight 262.31 g/mol
Molecular Formula C14H18N2O3
Exact Mass 262.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EZ6FpPKE2Ys
Name N-(1,3-Benzodioxol-5-yl)-N'-cyclohexylurea
Comments Computed using HOSE algorithm
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Exact Mass 262.131742445 u
Formula C14H18N2O3
InChI InChI=1S/C14H18N2O3/c17-14(15-10-4-2-1-3-5-10)16-11-6-7-12-13(8-11)19-9-18-12/h6-8,10H,1-5,9H2,(H2,15,16,17)
InChIKey HLNZLRJBWHJAJM-UHFFFAOYSA-N
Molecular Weight 262.309 g/mol
SMILES N(C(NC1CCCCC1)=O)C=1C=C2OCOC2=CC1