CID 51260

2-bromo-2'-fluoro-n-methyldiethylamine hydrochloride

Structural Information

Molecular Formula
C5H11BrFN
SMILES
CN(CCF)CCBr
InChI
InChI=1S/C5H11BrFN/c1-8(4-2-6)5-3-7/h2-5H2,1H3
InChIKey
YIKWUNYEHWRWQU-UHFFFAOYSA-N
Compound name
N-(2-bromoethyl)-2-fluoro-N-methylethanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

183.00589 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.01317 132.7
[M+Na]+ 205.99511 143.0
[M-H]- 181.99861 135.7
[M+NH4]+ 201.03971 156.4
[M+K]+ 221.96905 133.8
[M+H-H2O]+ 166.00315 131.8
[M+HCOO]- 228.00409 154.5
[M+CH3COO]- 242.01974 185.7
[M+Na-2H]- 203.98056 140.0
[M]+ 183.00534 151.0
[M]- 183.00644 151.0
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.