CID 10955039

Bis(4-fluorophenyl)methanamine

Structural Information

Molecular Formula
C13H11F2N
SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)F)N)F
InChI
InChI=1S/C13H11F2N/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,13H,16H2
InChIKey
WRKGTUUHIURRMW-UHFFFAOYSA-N
Compound name
bis(4-fluorophenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

156
Patents

219.08595 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.093226 145.5
[M+Na]+ 242.075168 153.5
[M-H]- 218.078674 149.4
[M+NH4]+ 237.119773 163.3
[M+K]+ 258.049108 148.9
[M+H-H2O]+ 202.083210 136.7
[M+HCOO]- 264.084151 167.5
[M+CH3COO]- 278.099801 191.7
[M+Na-2H]- 240.060616 149.5
[M]+ 219.08540142 140.5
[M]- 219.08649858 140.5
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

patents stripe