CID 6410405

1,2,4-triazino[5,6-c]quinolin-3-amine

Structural Information

Molecular Formula
C10H7N5
SMILES
C1=CC=C2C(=C1)C3=C(C=N2)N=C(N=N3)N
InChI
InChI=1S/C10H7N5/c11-10-13-8-5-12-7-4-2-1-3-6(7)9(8)14-15-10/h1-5H,(H2,11,13,15)
InChIKey
HPTDUGRASPFLEE-UHFFFAOYSA-N
Compound name
[1,2,4]triazino[5,6-c]quinolin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

197.07014 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.07742 141.0
[M+Na]+ 220.05936 153.2
[M-H]- 196.06286 141.5
[M+NH4]+ 215.10396 156.6
[M+K]+ 236.03330 147.4
[M+H-H2O]+ 180.06740 131.7
[M+HCOO]- 242.06834 161.3
[M+CH3COO]- 256.08399 153.6
[M+Na-2H]- 218.04481 154.3
[M]+ 197.06959 141.4
[M]- 197.07069 141.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.