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Product Overview

Product Code

TRC-M323773

CAS Number

21606-04-2

Product Format

Neat

Molecular Formula

C13 H18 N6 O3

Molecular Weight

306.32

Product Information

Analyte Name

Methyl 3-Nitrophthalate

CAS Number

21606-04-2

Molecular Formula

C13 H18 N6 O3

Molecular Weight

306.32

Accurate Mass

306.144

SMILES

CN(C)\C=N\c1ncc2ncn([C@H]3C[C@H](O)[C@@H](CO)O3)c2n1

InChI

InChI=1S/C13H18N6O3/c1-18(2)6-16-13-14-4-8-12(17-13)19(7-15-8)11-3-9(21)10(5-20)22-11/h4,6-7,9-11,20-21H,3,5H2,1-2H3/b16-6+/t9-,10+,11+/m0/s1

IUPAC

N'-[9-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]purin-2-yl]-N,N-dimethylmethanimidamide

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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