CID 13266661

91532-90-0

Structural Information

Molecular Formula
C18H19N3O
SMILES
C1CN2C(CN1C3=CC=CC=C3)CN(C2=O)C4=CC=CC=C4
InChI
InChI=1S/C18H19N3O/c22-18-20-12-11-19(15-7-3-1-4-8-15)13-17(20)14-21(18)16-9-5-2-6-10-16/h1-10,17H,11-14H2
InChIKey
FFMAJYHPRXRCDQ-UHFFFAOYSA-N
Compound name
2,7-diphenyl-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.1528 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.160076 170.5
[M+Na]+ 316.142018 176.7
[M-H]- 292.145524 176.1
[M+NH4]+ 311.186623 183.7
[M+K]+ 332.115958 170.7
[M+H-H2O]+ 276.150060 159.2
[M+HCOO]- 338.151001 185.8
[M+CH3COO]- 352.166651 180.0
[M+Na-2H]- 314.127466 172.1
[M]+ 293.15225142 165.3
[M]- 293.15334858 165.3
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.