hexan-1-amine; 4-methylbenzenesulfonic acid

Systemtic Name: hexan-1-amine; 4-methylbenzenesulfonic acid Openeye Name: hexan-1-amine; 4-methylbenzenesulfonic acid CAS Name: 1-hexanamine; 4-methylbenzenesulfonic acid IUPAC Name: hexan-1-amine; 4-methylbenzenesulfonic acid Traditional Name: hexylamine; tosylic acid Formula: C13H23NO3S MolecularWeight: 273.39162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN.CC1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCN.CC1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C7H8O3S.C6H15N/c1-6-2-4-7(5-3-6)11(8,9)10;1-2-3-4-5-6-7/h2-5H,1H3,(H,8,9,10);2-7H2,1H3