CID 3053031

As-triazine, 5,6-di-2-pyridyl-3-methoxy-

Structural Information

Molecular Formula
C14H11N5O
SMILES
COC1=NC(=C(N=N1)C2=CC=CC=N2)C3=CC=CC=N3
InChI
InChI=1S/C14H11N5O/c1-20-14-17-12(10-6-2-4-8-15-10)13(18-19-14)11-7-3-5-9-16-11/h2-9H,1H3
InChIKey
MLUIUAAAHCMGQS-UHFFFAOYSA-N
Compound name
3-methoxy-5,6-dipyridin-2-yl-1,2,4-triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

265.09637 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.10365 160.3
[M+Na]+ 288.08559 178.2
[M+NH4]+ 283.13019 167.2
[M+K]+ 304.05953 170.2
[M-H]- 264.08909 164.5
[M+Na-2H]- 286.07104 172.8
[M]+ 265.09582 164.2
[M]- 265.09692 164.2
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