Analyte Name

1,4,8,11-Tetraazacyclotetradecane-1,4,8,11-tetraacetic Acid-d8 Hydrochloride

Molecular Formula

C18H24D8N4O8 • 4(HCl)

Molecular Weight

586.36

Accurate Mass

584.19

SMILES

OC(C([2H])(N(CCN(C([2H])(C(O)=O)[2H])CCCN(CC1)C([2H])(C(O)=O)[2H])CCCN1C([2H])(C(O)=O)[2H])[2H])=O.Cl.Cl.Cl.Cl

InChI

InChI=1S/C18H32N4O8.4ClH/c23-15(24)11-19-3-1-4-20(12-16(25)26)8-10-22(14-18(29)30)6-2-5-21(9-7-19)13-17(27)28;;;;/h1-14H2,(H,23,24)(H,25,26)(H,27,28)(H,29,30);4*1H/i11D2,12D2,13D2,14D2;;;;

IUPAC

2,2',2'',2'''-(1,4,8,11-tetraazacyclotetradecane-1,4,8,11-tetrayl)tetrakis(acetic-2,2,2',2',2'',2'',2''',2'''-d8 acid) tetrahydrochloride

Unlabelled CAS Number

78668-42-5; 60239-22-7 free amine

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat