pentan-3-one; 2-pentylpropane-1,3-diamine

Systemtic Name: pentan-3-one; 2-pentylpropane-1,3-diamine Openeye Name: pentan-3-one; 2-pentylpropane-1,3-diamine CAS Name: 3-pentanone; 2-pentylpropane-1,3-diamine IUPAC Name: pentan-3-one; 2-pentylpropane-1,3-diamine Traditional Name: 2-(aminomethyl)heptylamine; pentan-3-one Formula: C13H30N2O MolecularWeight: 230.3901

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CN)CN.CCC(=O)CC

Isomeric SMILES

CCCCCC(CN)CN.CCC(=O)CC

InChI

InChI=1S/C8H20N2.C5H10O/c1-2-3-4-5-8(6-9)7-10;1-3-5(6)4-2/h8H,2-7,9-10H2,1H3;3-4H2,1-2H3