CID 43185145

(4-chlorophenyl)[4-(trifluoromethyl)phenyl]methanamine

Structural Information

Molecular Formula
C14H11ClF3N
SMILES
C1=CC(=CC=C1C(C2=CC=C(C=C2)Cl)N)C(F)(F)F
InChI
InChI=1S/C14H11ClF3N/c15-12-7-3-10(4-8-12)13(19)9-1-5-11(6-2-9)14(16,17)18/h1-8,13H,19H2
InChIKey
UZRCQRBBNQCEJB-UHFFFAOYSA-N
Compound name
(4-chlorophenyl)-[4-(trifluoromethyl)phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

285.05322 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.060496 159.0
[M+Na]+ 308.042438 168.0
[M-H]- 284.045944 161.4
[M+NH4]+ 303.087043 175.1
[M+K]+ 324.016378 161.2
[M+H-H2O]+ 268.050480 150.2
[M+HCOO]- 330.051421 173.5
[M+CH3COO]- 344.067071 201.0
[M+Na-2H]- 306.027886 162.1
[M]+ 285.05267142 155.0
[M]- 285.05376858 155.0
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.