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Reference substances

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Reference substance information

IUPAC name:
Amines, C12-18-alkyldimethyl, hydrochlorides

Molecular and structural information

Molecular formula:
Representative molecular formula of the major constituents, as the substance is an UVCB:
C12:C14H32CL1N1
C14: C16H36CL1N1
C16:C18H40CL1N1
C18: C20H44CL1N1
Molecular weight:
ca. 248.86 - ca. 333.03
SMILES notation:
Representative SMILEs of the major constituents, as the substance is an UVCB:
C12: CCCCCCCCCCCCN(C)C.Cl
C14: CCCCCCCCCCCCCCN(C)C.Cl
C16: CCCCCCCCCCCCCCN(C)C.Cl
C18: CCCCCCCCCCCCCCCCCCN(C)C.Cl
InChl:
Representative InChI of the major constituents, as the substance is an UVCB:
C12: InChI=1S/C14H32ClN/c1-4-5-6-7-8-9-10-11-12-13-14-16(2,3)15/h16H,4-14H2,1-3H3
C14: InChI=1S/C16H36ClN/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18(2,3)17/h18H,4-16H2,1-3H3
C16: InChI=1S/C18H40ClN/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(2,3)19/h20H,4-18H2,1-3H3
C18: InChI=1S/C20H44ClN/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22(2,3)21/h22H,4-20H2,1-3H3



Structural formula:
Chemical structure