CID 304812

N-(2-amino-4,5-dichlorophenyl)acetamide

Structural Information

Molecular Formula
C8H8Cl2N2O
SMILES
CC(=O)NC1=CC(=C(C=C1N)Cl)Cl
InChI
InChI=1S/C8H8Cl2N2O/c1-4(13)12-8-3-6(10)5(9)2-7(8)11/h2-3H,11H2,1H3,(H,12,13)
InChIKey
RFAVPISRRMQCOS-UHFFFAOYSA-N
Compound name
N-(2-amino-4,5-dichlorophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

218.00137 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.00865 143.6
[M+Na]+ 240.99059 153.7
[M-H]- 216.99409 146.9
[M+NH4]+ 236.03519 163.1
[M+K]+ 256.96453 148.5
[M+H-H2O]+ 200.99863 139.9
[M+HCOO]- 262.99957 159.6
[M+CH3COO]- 277.01522 190.7
[M+Na-2H]- 238.97604 147.0
[M]+ 218.00082 144.9
[M]- 218.00192 144.9
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