CID 21775921

2-bromo-2-iodoacetamide

Structural Information

Molecular Formula
C2H3BrINO
SMILES
C(C(=O)N)(Br)I
InChI
InChI=1S/C2H3BrINO/c3-1(4)2(5)6/h1H,(H2,5,6)
InChIKey
XQMKVQDLGURGON-UHFFFAOYSA-N
Compound name
2-bromo-2-iodoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

262.84427 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.85155 136.0
[M+Na]+ 285.83349 140.0
[M-H]- 261.83699 132.6
[M+NH4]+ 280.87809 154.6
[M+K]+ 301.80743 136.3
[M+H-H2O]+ 245.84153 132.6
[M+HCOO]- 307.84247 152.1
[M+CH3COO]- 321.85812 184.4
[M+Na-2H]- 283.81894 130.3
[M]+ 262.84372 148.4
[M]- 262.84482 148.4
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