Analyte Name

Triethylenetetraminehexakis(methylphosphonic Acid)-d12

Molecular Formula

C12 D12 H24 N4 O18 P6

Molecular Weight

722.347

Accurate Mass

722.12

SMILES

[2H]C([2H])(N(CCN(CCN(C([2H])([2H])P(=O)(O)O)C([2H])([2H])P(=O)(O)O)C([2H])([2H])P(=O)(O)O)CCN(C([2H])([2H])P(=O)(O)O)C([2H])([2H])P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C12H36N4O18P6/c17-35(18,19)7-13(3-5-15(9-37(23,24)25)10-38(26,27)28)1-2-14(8-36(20,21)22)4-6-16(11-39(29,30)31)12-40(32,33)34/h1-12H2,(H2,17,18,19)(H2,20,21,22)(H2,23,24,25)(H2,26,27,28)(H2,29,30,31)(H2,32,33,34)/i7D2,8D2,9D2,10D2,11D2,12D2

IUPAC

[[2-[bis[dideuterio(phosphono)methyl]amino]ethyl-[2-[2-[bis[dideuterio(phosphono)methyl]amino]ethyl-[dideuterio(phosphono)methyl]amino]ethyl]amino]-dideuteriomethyl]phosphonic acid

Unlabelled CAS Number

36475-52-2

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat