CID 121949

Mpdhip

Structural Information

Molecular Formula
C13H11N3O
SMILES
CC1=NC2=CN(C=CN2C1=O)C3=CC=CC=C3
InChI
InChI=1S/C13H11N3O/c1-10-13(17)16-8-7-15(9-12(16)14-10)11-5-3-2-4-6-11/h2-9H,1H3
InChIKey
BWZMTZXTIFIVPT-UHFFFAOYSA-N
Compound name
2-methyl-7-phenylimidazo[1,2-a]pyrazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

32
References

0
Patents

225.09021 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.09749 148.8
[M+Na]+ 248.07943 160.3
[M-H]- 224.08293 153.4
[M+NH4]+ 243.12403 166.0
[M+K]+ 264.05337 155.3
[M+H-H2O]+ 208.08747 139.8
[M+HCOO]- 270.08841 170.5
[M+CH3COO]- 284.10406 162.0
[M+Na-2H]- 246.06488 155.3
[M]+ 225.08966 150.5
[M]- 225.09076 150.5
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.