CID 3086269

Benzamide, 2-((dichloroacetyl)amino)-

Structural Information

Molecular Formula
C9H8Cl2N2O2
SMILES
C1=CC=C(C(=C1)C(=O)N)NC(=O)C(Cl)Cl
InChI
InChI=1S/C9H8Cl2N2O2/c10-7(11)9(15)13-6-4-2-1-3-5(6)8(12)14/h1-4,7H,(H2,12,14)(H,13,15)
InChIKey
CTPFAVZEPCBUKH-UHFFFAOYSA-N
Compound name
2-[(2,2-dichloroacetyl)amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

245.99628 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.00356 149.2
[M+Na]+ 268.98550 160.1
[M+NH4]+ 264.03010 156.4
[M+K]+ 284.95944 154.9
[M-H]- 244.98900 150.6
[M+Na-2H]- 266.97095 154.4
[M]+ 245.99573 151.4
[M]- 245.99683 151.4
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