CID 135463200

2-methyl-5h,6h-[1,2,4]triazolo[1,5-c]quinazolin-5-one

Structural Information

Molecular Formula
C10H8N4O
SMILES
CC1=NN2C(=N1)C3=CC=CC=C3NC2=O
InChI
InChI=1S/C10H8N4O/c1-6-11-9-7-4-2-3-5-8(7)12-10(15)14(9)13-6/h2-5H,1H3,(H,12,15)
InChIKey
PDPQZGXLYBPJGK-UHFFFAOYSA-N
Compound name
2-methyl-6H-[1,2,4]triazolo[1,5-c]quinazolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

2
Patents

200.06981 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.07709 141.0
[M+Na]+ 223.05903 156.9
[M+NH4]+ 218.10363 148.9
[M+K]+ 239.03297 151.9
[M-H]- 199.06253 141.5
[M+Na-2H]- 221.04448 147.6
[M]+ 200.06926 143.4
[M]- 200.07036 143.4
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

patents stripe