CID 21678931

4-fluoro-n,n-diphenylaniline

Structural Information

Molecular Formula
C18H14FN
SMILES
C1=CC=C(C=C1)N(C2=CC=CC=C2)C3=CC=C(C=C3)F
InChI
InChI=1S/C18H14FN/c19-15-11-13-18(14-12-15)20(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-14H
InChIKey
LQDQVCOHANBTIC-UHFFFAOYSA-N
Compound name
4-fluoro-N,N-diphenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

263.11102 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.11830 159.0
[M+Na]+ 286.10024 165.5
[M-H]- 262.10374 168.4
[M+NH4]+ 281.14484 175.1
[M+K]+ 302.07418 160.7
[M+H-H2O]+ 246.10828 148.9
[M+HCOO]- 308.10922 183.7
[M+CH3COO]- 322.12487 171.2
[M+Na-2H]- 284.08569 165.7
[M]+ 263.11047 156.6
[M]- 263.11157 156.6
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