CID 236221

N,n'-bis(4-chlorophenyl)oxamide

Structural Information

Molecular Formula
C14H10Cl2N2O2
SMILES
C1=CC(=CC=C1NC(=O)C(=O)NC2=CC=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H10Cl2N2O2/c15-9-1-5-11(6-2-9)17-13(19)14(20)18-12-7-3-10(16)4-8-12/h1-8H,(H,17,19)(H,18,20)
InChIKey
GRBNSXNIWBORQH-UHFFFAOYSA-N
Compound name
N,N'-bis(4-chlorophenyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

6
Patents

308.01193 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.01921 166.1
[M+Na]+ 331.00115 174.2
[M-H]- 307.00465 172.4
[M+NH4]+ 326.04575 181.6
[M+K]+ 346.97509 168.1
[M+H-H2O]+ 291.00919 160.1
[M+HCOO]- 353.01013 181.8
[M+CH3COO]- 367.02578 204.5
[M+Na-2H]- 328.98660 169.8
[M]+ 308.01138 168.4
[M]- 308.01248 168.4
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

patents stripe