CID 16228741

2-fluoro-1-phenylethan-1-amine

Structural Information

Molecular Formula
C8H10FN
SMILES
C1=CC=C(C=C1)C(CF)N
InChI
InChI=1S/C8H10FN/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8H,6,10H2
InChIKey
KSWGCLOZHMSHGB-UHFFFAOYSA-N
Compound name
2-fluoro-1-phenylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

54
Patents

139.07973 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.08701 126.9
[M+Na]+ 162.06895 133.6
[M-H]- 138.07245 128.7
[M+NH4]+ 157.11355 147.9
[M+K]+ 178.04289 131.6
[M+H-H2O]+ 122.07699 120.3
[M+HCOO]- 184.07793 150.1
[M+CH3COO]- 198.09358 176.0
[M+Na-2H]- 160.05440 133.1
[M]+ 139.07918 122.9
[M]- 139.08028 122.9
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