Analyte Name

8-Oxo-2'-deoxyadenosine-13C2,15N

Molecular Formula

C8¹³C2H13N4¹⁵NO4

Molecular Weight

270.22

Accurate Mass

270.1

SMILES

NC1=NC=N[13C]2=C1[15N]=[13C](O)N2[C@H]3C[C@H](O)[C@@H](CO)O3

InChI

InChI=1S/C10H13N5O4/c11-8-7-9(13-3-12-8)15(10(18)14-7)6-1-4(17)5(2-16)19-6/h3-6,16-17H,1-2H2,(H,14,18)(H2,11,12,13)/t4-,5+,6+/m0/s1/i9+1,10+1,14+1

IUPAC

6-amino-9-((2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)-9H-purin-8-ol-4,8-13C2-7-15N

Unlabelled CAS Number

62471-63-0

SIL Type

Nitrogen, Carbon

Country of Origin

CANADA

Product Type

Stable Isotope Labelled

Product Format

Neat