CID 83350178

2490404-57-2

Structural Information

Molecular Formula
C8H9FIN
SMILES
CC(C1=C(C=CC=C1I)F)N
InChI
InChI=1S/C8H9FIN/c1-5(11)8-6(9)3-2-4-7(8)10/h2-5H,11H2,1H3
InChIKey
VYAUATMUPPWROE-UHFFFAOYSA-N
Compound name
1-(2-fluoro-6-iodophenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

264.97638 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.98366 142.7
[M+Na]+ 287.96560 146.7
[M+NH4]+ 283.01020 146.8
[M+K]+ 303.93954 143.8
[M-H]- 263.96910 138.1
[M+Na-2H]- 285.95105 136.2
[M]+ 264.97583 140.8
[M]- 264.97693 140.8
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.