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Reference substances

Reference substances

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General information

Inventory

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Reference substance information

IUPAC name:
N-(3-ammoniopropyl)-N'-hexadecylpropane-1,3-diaminium triacetate

Molecular and structural information

Molecular formula:
C28H61N3O6
Molecular weight:
535.8
SMILES notation:
CCCCCCCCCCCCCCCC[NH2+]CCC[NH2+]CCC[NH3+].CC([O-])=O.CC([O-])=O.CC([O-])=O
InChl:
InChI=1S/C22H49N3.3C2H4O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24-21-17-22-25-20-16-18-23;3*1-2(3)4/h24-25H,2-23H2,1H3;3*1H3,(H,3,4)
Structural formula:
Chemical structure