Analyte Name

O-Benzyl Tazobactam-d4

Molecular Formula

C17 D4 H14 N4 O5 S

Molecular Weight

394.438

Accurate Mass

394.125

SMILES

[2H]C([2H])(n1ccnn1)[C@@]2(C)[C@@H](N3[C@@H](C([2H])([2H])C3=O)S2(=O)=O)C(=O)OCc4ccccc4

InChI

InChI=1S/C17H18N4O5S/c1-17(11-20-8-7-18-19-20)15(21-13(22)9-14(21)27(17,24)25)16(23)26-10-12-5-3-2-4-6-12/h2-8,14-15H,9-11H2,1H3/t14-,15+,17+/m1/s1/i9D2,11D2

IUPAC

benzyl (2S,3S,5R)-6,6-dideuterio-3-[dideuterio(triazol-1-yl)methyl]-3-methyl-4,4,7-trioxo-4?6-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

Unlabelled CAS Number

117030-07-6

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat