N-ethylethanamine; octyl hydrogen sulfate

Systemtic Name: N-ethylethanamine; octyl hydrogen sulfate Openeye Name: N-ethylethanamine; octyl hydrogen sulfate CAS Name: N-ethylethanamine; sulfuric acid octyl ester IUPAC Name: N-ethylethanamine; octyl hydrogen sulfate Traditional Name: diethylamine; sulfuric acid octyl ester Formula: C12H29NO4S MolecularWeight: 283.42796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOS(=O)(=O)O.CCNCC

Isomeric SMILES

CCCCCCCCOS(=O)(=O)O.CCNCC

InChI

InChI=1S/C8H18O4S.C4H11N/c1-2-3-4-5-6-7-8-12-13(9,10)11;1-3-5-4-2/h2-8H2,1H3,(H,9,10,11);5H,3-4H2,1-2H3