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Butanoic acid, 4-[[(ethylphenylamino)carbonyl]amino]-
SpectraBase Compound ID 3AskZHzmLkP
InChI InChI=1S/C13H18N2O3/c1-2-15(11-7-4-3-5-8-11)13(18)14-10-6-9-12(16)17/h3-5,7-8H,2,6,9-10H2,1H3,(H,14,18)(H,16,17)
InChIKey DWCWUOYTLZQBPF-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C13H18N2O3
Exact Mass 250.131742 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9fPSBqiP5OR
Name Butanoic acid, 4-[[(ethylphenylamino)carbonyl]amino]-
Comments Computed using HOSE algorithm
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Exact Mass 250.131742445 u
Formula C13H18N2O3
InChI InChI=1S/C13H18N2O3/c1-2-15(11-7-4-3-5-8-11)13(18)14-10-6-9-12(16)17/h3-5,7-8H,2,6,9-10H2,1H3,(H,14,18)(H,16,17)
InChIKey DWCWUOYTLZQBPF-UHFFFAOYSA-N
Molecular Weight 250.298 g/mol
SMILES N(C(N(C=1C=CC=CC1)CC)=O)CCCC(=O)O