CID 3765310

2-phenylimidazo[2,1-a]phthalazin-6-amine

Structural Information

Molecular Formula
C16H12N4
SMILES
C1=CC=C(C=C1)C2=CN3C(=N2)C4=CC=CC=C4C(=N3)N
InChI
InChI=1S/C16H12N4/c17-15-12-8-4-5-9-13(12)16-18-14(10-20(16)19-15)11-6-2-1-3-7-11/h1-10H,(H2,17,19)
InChIKey
FPZLJNFFUADCKW-UHFFFAOYSA-N
Compound name
2-phenylimidazo[2,1-a]phthalazin-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

7
References

0
Patents

260.1062 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.113476 157.9
[M+Na]+ 283.095418 169.5
[M-H]- 259.098924 163.1
[M+NH4]+ 278.140023 174.0
[M+K]+ 299.069358 162.3
[M+H-H2O]+ 243.103460 148.2
[M+HCOO]- 305.104401 179.7
[M+CH3COO]- 319.120051 170.3
[M+Na-2H]- 281.080866 166.5
[M]+ 260.10565142 158.6
[M]- 260.10674858 158.6
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.