CID 51262

Diethylamine, 2-bromo-2'-iodo-, hydrochloride

Structural Information

Molecular Formula
C4H9BrIN
SMILES
C(CBr)NCCI
InChI
InChI=1S/C4H9BrIN/c5-1-3-7-4-2-6/h7H,1-4H2
InChIKey
UACPYBANFVGOKV-UHFFFAOYSA-N
Compound name
2-bromo-N-(2-iodoethyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.8963 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.90358 141.3
[M+Na]+ 299.88552 144.8
[M-H]- 275.88902 137.8
[M+NH4]+ 294.93012 159.9
[M+K]+ 315.85946 140.4
[M+H-H2O]+ 259.89356 137.7
[M+HCOO]- 321.89450 158.8
[M+CH3COO]- 335.91015 188.0
[M+Na-2H]- 297.87097 137.9
[M]+ 276.89575 155.8
[M]- 276.89685 155.8
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.