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]+ 294.16008 170.5
[M+Na]+ 316.14202 176.7
[M-H]- 292.14552 176.1
[M+NH4]+ 311.18662 183.7
[M+K]+ 332.11596 170.7
[M+H-H2O]+ 276.15006 159.2
[M+HCOO]- 338.15100 185.8
[M+CH3COO]- 352.16665 180.0
[M+Na-2H]- 314.12747 172.1
[M]+ 293.15225 165.3
[M]- 293.15335 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.