Analyte Name

Cotrimoxazole-13C-d3

Molecular Formula

13C C13 H15 D3 N4 O3 . C10 H11 N3 O3 S

Molecular Weight

547.61

Accurate Mass

547.21

SMILES

NC1=C(CC2=CC(OC)=C(C(OC)=C2)O[13C]([2H])([2H])[2H])C=NC(N)=N1.NC3=CC=C(C=C3)S(=O)(NC4=NOC(C)=C4)=O

InChI

InChI=1S/C14H18N4O3.C10H11N3O3S/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15;1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h5-7H,4H2,1-3H3,(H4,15,16,17,18);2-6H,11H2,1H3,(H,12,13)/i3+1D3;

IUPAC

4-amino-N-(5-methylisoxazol-3-yl)benzenesulfonamide--5-(3,5-dimethoxy-4-(methoxy-13C-d3)benzyl)pyrimidine-2,4-diamine (1/1)

Unlabelled CAS Number

8064-90-2

SIL Type

Carbon, Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat