CID 3456924

2-chloro-n-[4-(2-chloroacetamido)-3-nitrophenyl]acetamide

Structural Information

Molecular Formula
C10H9Cl2N3O4
SMILES
C1=CC(=C(C=C1NC(=O)CCl)[N+](=O)[O-])NC(=O)CCl
InChI
InChI=1S/C10H9Cl2N3O4/c11-4-9(16)13-6-1-2-7(14-10(17)5-12)8(3-6)15(18)19/h1-3H,4-5H2,(H,13,16)(H,14,17)
InChIKey
GAKGUNXCSNEHFU-UHFFFAOYSA-N
Compound name
2-chloro-N-[4-[(2-chloroacetyl)amino]-3-nitrophenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

304.997 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.00428 160.6
[M+Na]+ 327.98622 171.8
[M+NH4]+ 323.03082 166.7
[M+K]+ 343.96016 169.0
[M-H]- 303.98972 162.7
[M+Na-2H]- 325.97167 165.0
[M]+ 304.99645 162.9
[M]- 304.99755 162.9
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

No patent data available for this compound.