CID 44629774

9,9-bis(4-amino-3-fluorophenyl)fluorene

Structural Information

Molecular Formula
C25H18F2N2
SMILES
C1=CC=C2C(=C1)C3=CC=CC=C3C2(C4=CC(=C(C=C4)N)F)C5=CC(=C(C=C5)N)F
InChI
InChI=1S/C25H18F2N2/c26-21-13-15(9-11-23(21)28)25(16-10-12-24(29)22(27)14-16)19-7-3-1-5-17(19)18-6-2-4-8-20(18)25/h1-14H,28-29H2
InChIKey
RXNKCIBVUNMMAD-UHFFFAOYSA-N
Compound name
4-[9-(4-amino-3-fluorophenyl)fluoren-9-yl]-2-fluoroaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1366
Patents

384.1438 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.15108 192.4
[M+Na]+ 407.13302 203.4
[M-H]- 383.13652 201.6
[M+NH4]+ 402.17762 208.9
[M+K]+ 423.10696 193.8
[M+H-H2O]+ 367.14106 181.2
[M+HCOO]- 429.14200 213.0
[M+CH3COO]- 443.15765 202.7
[M+Na-2H]- 405.11847 194.3
[M]+ 384.14325 188.6
[M]- 384.14435 188.6
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

patents stripe