CAS Registry Number: 310431-29-9

Name:

Pyrrolo[2,​1-​f]​[1,​2,​4]​triazine-​6-​carboxylic acid, 1,​4-​dihydro-​5-​methyl-​4-​oxo-​, methyl ester
5-​Methyl-​4-​oxo-​3,​4-​dihydropyrrolo[2,​1-​f]​[1,​2,​4]​triazine-​6-​carboxylic acid methyl ester 

Chemical Formula: C9H9N3O3
Exact Mass: 207.06
Molecular Weight: 207.19
m/z: 207.06 (100.0%), 208.07 (10.0%), 208.06 (1.1%), 209.07 (1.1%)
Elemental Analysis: C, 52.17; H, 4.38; N, 20.28; O, 23.17

InChI: InChI=1S/C9H9N3O3/c1-5-6(9(14)15-2)3-12-7(5)8(13)10-4-11-12/h3-4H,1-2H3,(H,10,11,13)
InChIKey: PMKPHIGFZNWPQI-UHFFFAOYSA-N
Canonical SMILES : CC1=C2C(=O)N=CNN2C=C1C(=O)OC

Specification

98%

PCT Int. Appl. (2003), WO 2003042172 A2 20030522.                                  

PCT Int. Appl. (2002), WO 2002040486 A2 20020523.