CID 278817

10173-67-8

Structural Information

Molecular Formula
C20H12F2N4
SMILES
C1=CC=C2C(=C1)N=C3N2C(=NC4=C3C=C(C=C4)F)C5=C(C=CC(=C5)F)N
InChI
InChI=1S/C20H12F2N4/c21-11-5-7-15(23)13(9-11)19-24-16-8-6-12(22)10-14(16)20-25-17-3-1-2-4-18(17)26(19)20/h1-10H,23H2
InChIKey
HDNAALGKCBLYQJ-UHFFFAOYSA-N
Compound name
4-fluoro-2-(2-fluorobenzimidazolo[1,2-c]quinazolin-6-yl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.103 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.11028 180.8
[M+Na]+ 369.09222 195.5
[M-H]- 345.09572 185.3
[M+NH4]+ 364.13682 194.8
[M+K]+ 385.06616 185.6
[M+H-H2O]+ 329.10026 168.6
[M+HCOO]- 391.10120 199.8
[M+CH3COO]- 405.11685 191.9
[M+Na-2H]- 367.07767 187.1
[M]+ 346.10245 182.2
[M]- 346.10355 182.2
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.