CID 516615

121845-65-6

Structural Information

Molecular Formula
C11H7N5
SMILES
C1=CC=NC(=C1)C2=NC3=C(C=CN=C3)N=N2
InChI
InChI=1S/C11H7N5/c1-2-5-13-9(3-1)11-14-10-7-12-6-4-8(10)15-16-11/h1-7H
InChIKey
UWOUQHOBPISZHS-UHFFFAOYSA-N
Compound name
3-pyridin-2-ylpyrido[3,4-e][1,2,4]triazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

209.07014 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.07742 146.4
[M+Na]+ 232.05936 156.9
[M-H]- 208.06286 147.2
[M+NH4]+ 227.10396 158.8
[M+K]+ 248.03330 151.1
[M+H-H2O]+ 192.06740 135.2
[M+HCOO]- 254.06834 164.4
[M+CH3COO]- 268.08399 157.8
[M+Na-2H]- 230.04481 158.5
[M]+ 209.06959 145.8
[M]- 209.07069 145.8
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

No patent data available for this compound.