CID 54595392

[2-amino-1-(4-fluorophenyl)ethyl](methyl)amine

Structural Information

Molecular Formula
C9H13FN2
SMILES
CNC(CN)C1=CC=C(C=C1)F
InChI
InChI=1S/C9H13FN2/c1-12-9(6-11)7-2-4-8(10)5-3-7/h2-5,9,12H,6,11H2,1H3
InChIKey
GSNWKFMRWMKZKJ-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-N-methylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.10628 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.11356 135.1
[M+Na]+ 191.09550 145.3
[M+NH4]+ 186.14010 143.2
[M+K]+ 207.06944 139.3
[M-H]- 167.09900 137.1
[M+Na-2H]- 189.08095 141.4
[M]+ 168.10573 136.8
[M]- 168.10683 136.8
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.