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Reference substances

Reference substances

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IUPAC name:
Group of constituents (mainly C12, C14-alkyl derivatives) in Reaction products of 1H-Imidazole-1-ethanol, 4,5-dihydro-, 2-(C11-C13 odd-numbered alkyl) derivs. and sodium hydroxide and chloroacetic acid

Inventory

Synonyms

Molecular and structural information

Molecular formula:
For the 4 representative main potential (C12-alkyl) structures:
C20H36N2O6Na2: 446 g/mol
and
C18H35N2O4Na: 367 g/mol
Molecular weight:
>= 367 - <= 474
SMILES notation:
For the 4 representative potential C12 structures:
C18H35N2O4Na:
CCCCCCCCCCCC(=O)NCCN(CCO)CC(=O)O[Na]
CCCCCCCCCCCC(=O)N(CCO)CCNCC(=O)O[Na]
C20H36N2O6Na2 :
CCCCCCCCCCCC(=O)NCCN(CCOCC(=O)O[Na])CC(=O)O[Na]
CCCCCCCCCCCC(=O)N(CCO)CCN(CC(=O)O[Na])CC(=O)O[Na]

For the 4 representative potential C14 structures:
C20H39N2O4Na:
CCCCCCCCCCCCCC(=O)NCCN(CCO)CC(=O)O[Na]
CCCCCCCCCCCCCC(=O)N(CCO)CCNCC(=O)O[Na]
C22H40N2O6Na2 :
CCCCCCCCCCCCCC(=O)NCCN(CCOCC(=O)O[Na])CC(=O)O[Na]
CCCCCCCCCCCCCC(=O)N(CCO)CCN(CC(=O)O[Na])CC(=O)O[Na]

The molecular weight range stated covers these 8 potential C12 and C14 structures.
InChl:
Not applicable (generic description of a group of unknown constituents)
Structural formula:
Chemical structure

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