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azanium octyl octanoate

azanium octyl octanoate

Systemtic Name:azanium octyl octanoate
Openeye Name:ammonium octyl octanoate
CAS Name:ammonium octanoic acid octyl ester
IUPAC Name:azanium octyl octanoate
Traditional Name:ammonium caprylic acid octyl ester
Formula: C16H36NO2+
MolecularWeight: 274.46254
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CCCCCCC.[NH4+]


Isomeric SMILES

CCCCCCCCOC(=O)CCCCCCC.[NH4+]


InChI

InChI=1S/C16H32O2.H3N/c1-3-5-7-9-11-13-15-18-16(17)14-12-10-8-6-4-2;/h3-15H2,1-2H3;1H3/p+1


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