CID 979098

Oprea1_089073

Structural Information

Molecular Formula
C20H14Cl2N2O2
SMILES
C1=CC=C(C(=C1)C(=O)NC2=CC=CC=C2NC(=O)C3=CC=CC=C3Cl)Cl
InChI
InChI=1S/C20H14Cl2N2O2/c21-15-9-3-1-7-13(15)19(25)23-17-11-5-6-12-18(17)24-20(26)14-8-2-4-10-16(14)22/h1-12H,(H,23,25)(H,24,26)
InChIKey
NOBNYGYYOZKKPS-UHFFFAOYSA-N
Compound name
2-chloro-N-[2-[(2-chlorobenzoyl)amino]phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

384.04324 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 385.05052 187.4
[M+Na]+ 407.03246 194.9
[M-H]- 383.03596 196.3
[M+NH4]+ 402.07706 199.4
[M+K]+ 423.00640 187.5
[M+H-H2O]+ 367.04050 179.5
[M+HCOO]- 429.04144 202.3
[M+CH3COO]- 443.05709 220.0
[M+Na-2H]- 405.01791 189.8
[M]+ 384.04269 190.1
[M]- 384.04379 190.1
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.