CID 41256

54955-04-3

Structural Information

Molecular Formula
C5H11FIN
SMILES
CN(CCF)CCI
InChI
InChI=1S/C5H11FIN/c1-8(4-2-6)5-3-7/h2-5H2,1H3
InChIKey
KKGQSKOFCOESCF-UHFFFAOYSA-N
Compound name
2-fluoro-N-(2-iodoethyl)-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.99203 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.999306 135.8
[M+Na]+ 253.981248 135.5
[M-H]- 229.984754 129.4
[M+NH4]+ 249.025853 153.4
[M+K]+ 269.955188 141.8
[M+H-H2O]+ 213.989290 126.3
[M+HCOO]- 275.990231 154.9
[M+CH3COO]- 290.005881 186.9
[M+Na-2H]- 251.966696 129.3
[M]+ 230.99148142 133.5
[M]- 230.99257858 133.5
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.