CID 54076816

2448484-69-1

Structural Information

Molecular Formula
C2H5ClFN
SMILES
C(C(F)Cl)N
InChI
InChI=1S/C2H5ClFN/c3-2(4)1-5/h2H,1,5H2
InChIKey
ANDCGAYBYYMAJG-UHFFFAOYSA-N
Compound name
2-chloro-2-fluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

54
Patents

97.00945 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 98.016726 113.1
[M+Na]+ 119.998668 121.6
[M-H]- 96.002174 111.9
[M+NH4]+ 115.043273 136.7
[M+K]+ 135.972608 119.8
[M+H-H2O]+ 80.006710 109.2
[M+HCOO]- 142.007651 131.9
[M+CH3COO]- 156.023301 166.6
[M+Na-2H]- 117.984116 119.2
[M]+ 97.00890142 110.9
[M]- 97.00999858 110.9
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