CID 784761

Benzyl[(4-fluorophenyl)methyl]amine

Structural Information

Molecular Formula
C14H14FN
SMILES
C1=CC=C(C=C1)CNCC2=CC=C(C=C2)F
InChI
InChI=1S/C14H14FN/c15-14-8-6-13(7-9-14)11-16-10-12-4-2-1-3-5-12/h1-9,16H,10-11H2
InChIKey
SXZSRGKJZKOZRP-UHFFFAOYSA-N
Compound name
N-[(4-fluorophenyl)methyl]-1-phenylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

50
Patents

215.11102 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.11830 146.0
[M+Na]+ 238.10024 152.9
[M-H]- 214.10374 151.2
[M+NH4]+ 233.14484 164.1
[M+K]+ 254.07418 148.3
[M+H-H2O]+ 198.10828 137.7
[M+HCOO]- 260.10922 170.4
[M+CH3COO]- 274.12487 190.7
[M+Na-2H]- 236.08569 153.3
[M]+ 215.11047 143.7
[M]- 215.11157 143.7
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