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tributylazanium diphosphate

tributylazanium diphosphate

Systemtic Name:tributylazanium diphosphate
Openeye Name:tributylammonium diphosphate
CAS Name:tributylammonium diphosphate
IUPAC Name:tributylazanium diphosphate
Traditional Name:tributylammonium diphosphate
Formula: C72H168N6O8P2
MolecularWeight: 1308.087242
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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]


Isomeric SMILES

CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.CCCC[NH+](CCCC)CCCC.[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-]


InChI

InChI=1S/6C12H27N.2H3O4P/c6*1-4-7-10-13(11-8-5-2)12-9-6-3;2*1-5(2,3)4/h6*4-12H2,1-3H3;2*(H3,1,2,3,4)


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