CID 13569520

2-(2-fluorophenyl)propan-2-amine

Structural Information

Molecular Formula
C9H12FN
SMILES
CC(C)(C1=CC=CC=C1F)N
InChI
InChI=1S/C9H12FN/c1-9(2,11)7-5-3-4-6-8(7)10/h3-6H,11H2,1-2H3
InChIKey
KAQOIUQXYMVFJE-UHFFFAOYSA-N
Compound name
2-(2-fluorophenyl)propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

153.09538 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.10266 132.1
[M+Na]+ 176.08460 143.7
[M+NH4]+ 171.12920 140.7
[M+K]+ 192.05854 137.7
[M-H]- 152.08810 133.5
[M+Na-2H]- 174.07005 139.1
[M]+ 153.09483 134.1
[M]- 153.09593 134.1
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