CID 159488

Diacetamide, 2,2'-diiodo-

Structural Information

Molecular Formula
C4H5I2NO2
SMILES
C(C(=O)NC(=O)CI)I
InChI
InChI=1S/C4H5I2NO2/c5-1-3(8)7-4(9)2-6/h1-2H2,(H,7,8,9)
InChIKey
RXPXVZKIHJHUMA-UHFFFAOYSA-N
Compound name
2-iodo-N-(2-iodoacetyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

352.84097 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.84825 142.6
[M+Na]+ 375.83019 135.2
[M-H]- 351.83369 132.3
[M+NH4]+ 370.87479 152.7
[M+K]+ 391.80413 146.7
[M+H-H2O]+ 335.83823 131.9
[M+HCOO]- 397.83917 154.8
[M+CH3COO]- 411.85482 198.5
[M+Na-2H]- 373.81564 129.3
[M]+ 352.84042 138.0
[M]- 352.84152 138.1
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

No patent data available for this compound.