CID 16228764

2375262-37-4

Structural Information

Molecular Formula
C8H9F2N
SMILES
C1=CC=C(C(=C1)C(CF)N)F
InChI
InChI=1S/C8H9F2N/c9-5-8(11)6-3-1-2-4-7(6)10/h1-4,8H,5,11H2
InChIKey
VWIAOZWPEBAVMJ-UHFFFAOYSA-N
Compound name
2-fluoro-1-(2-fluorophenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

157.07031 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.07759 129.2
[M+Na]+ 180.05953 136.9
[M-H]- 156.06303 129.9
[M+NH4]+ 175.10413 149.7
[M+K]+ 196.03347 134.5
[M+H-H2O]+ 140.06757 121.8
[M+HCOO]- 202.06851 151.3
[M+CH3COO]- 216.08416 179.9
[M+Na-2H]- 178.04498 134.0
[M]+ 157.06976 124.4
[M]- 157.07086 124.4
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