CID 220792

2-bromo-n-ethylacetamide

Structural Information

Molecular Formula
C4H8BrNO
SMILES
CCNC(=O)CBr
InChI
InChI=1S/C4H8BrNO/c1-2-6-4(7)3-5/h2-3H2,1H3,(H,6,7)
InChIKey
XZHKIYIYQHCBED-UHFFFAOYSA-N
Compound name
2-bromo-N-ethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

123
Patents

164.97893 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.98621 127.3
[M+Na]+ 187.96815 128.2
[M+NH4]+ 183.01275 131.7
[M+K]+ 203.94209 129.2
[M-H]- 163.97165 126.0
[M+Na-2H]- 185.95360 128.7
[M]+ 164.97838 125.6
[M]- 164.97948 125.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe