CID 167715513

(2-bromo-2-fluoroethyl)(methyl)amine hydrochloride

Structural Information

Molecular Formula
C3H7BrFN
SMILES
CNCC(F)Br
InChI
InChI=1S/C3H7BrFN/c1-6-2-3(4)5/h3,6H,2H2,1H3
InChIKey
KPWWOHQHCCLCCT-UHFFFAOYSA-N
Compound name
2-bromo-2-fluoro-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

154.9746 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 155.98188 124.3
[M+Na]+ 177.96382 135.0
[M-H]- 153.96732 126.3
[M+NH4]+ 173.00842 148.3
[M+K]+ 193.93776 125.4
[M+H-H2O]+ 137.97186 124.0
[M+HCOO]- 199.97280 145.4
[M+CH3COO]- 213.98845 177.4
[M+Na-2H]- 175.94927 132.1
[M]+ 154.97405 140.1
[M]- 154.97515 140.1
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.