CID 5116290

N-(4-acetylphenyl)-2-iodoacetamide

Structural Information

Molecular Formula
C10H10INO2
SMILES
CC(=O)C1=CC=C(C=C1)NC(=O)CI
InChI
InChI=1S/C10H10INO2/c1-7(13)8-2-4-9(5-3-8)12-10(14)6-11/h2-5H,6H2,1H3,(H,12,14)
InChIKey
JMHLGEVVEZBSSK-UHFFFAOYSA-N
Compound name
N-(4-acetylphenyl)-2-iodoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

96
Patents

302.97562 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.98290 154.4
[M+Na]+ 325.96484 154.0
[M-H]- 301.96834 151.0
[M+NH4]+ 321.00944 168.3
[M+K]+ 341.93878 158.1
[M+H-H2O]+ 285.97288 144.4
[M+HCOO]- 347.97382 172.8
[M+CH3COO]- 361.98947 194.7
[M+Na-2H]- 323.95029 146.1
[M]+ 302.97507 151.7
[M]- 302.97617 151.7
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

patents stripe