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: 153
Patents: 219.08595 Da
Monoisotopic Mass: 2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	220.09323	148.1
[M+Na]+	242.07517	160.8
[M+NH4]+	237.11977	156.3
[M+K]+	258.04911	153.3
[M-H]-	218.07867	150.9
[M+Na-2H]-	240.06062	156.6
[M]+	219.08540	150.6
[M]-	219.08650	150.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe