CID 3070767

1,2,4-triazolo(4,3-b)(1,2,4)triazine, 6,7-di-2-pyridinyl-3-methyl-

Structural Information

Molecular Formula
C15H11N7
SMILES
CC1=NN=C2N1N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4
InChI
InChI=1S/C15H11N7/c1-10-19-20-15-18-13(11-6-2-4-8-16-11)14(21-22(10)15)12-7-3-5-9-17-12/h2-9H,1H3
InChIKey
RJADFHMYUZMFRR-UHFFFAOYSA-N
Compound name
3-methyl-6,7-dipyridin-2-yl-[1,2,4]triazolo[4,3-b][1,2,4]triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

289.1076 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.11488 165.2
[M+Na]+ 312.09682 184.0
[M+NH4]+ 307.14142 171.8
[M+K]+ 328.07076 177.8
[M-H]- 288.10032 168.7
[M+Na-2H]- 310.08227 176.9
[M]+ 289.10705 169.0
[M]- 289.10815 169.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe