CID 9575571

[(z)-[amino-(2,4-dichlorophenyl)methylene]amino] 2,6-dichlorobenzoate

Structural Information

Molecular Formula
C14H8Cl4N2O2
SMILES
C1=CC(=C(C(=C1)Cl)C(=O)O/N=C(/C2=C(C=C(C=C2)Cl)Cl)\N)Cl
InChI
InChI=1S/C14H8Cl4N2O2/c15-7-4-5-8(11(18)6-7)13(19)20-22-14(21)12-9(16)2-1-3-10(12)17/h1-6H,(H2,19,20)
InChIKey
NGYNFULXTGGTNH-UHFFFAOYSA-N
Compound name
[(Z)-[amino-(2,4-dichlorophenyl)methylidene]amino] 2,6-dichlorobenzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

375.934 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.94128 178.4
[M+Na]+ 398.92322 187.9
[M-H]- 374.92672 182.9
[M+NH4]+ 393.96782 191.7
[M+K]+ 414.89716 181.7
[M+H-H2O]+ 358.93126 173.9
[M+HCOO]- 420.93220 183.8
[M+CH3COO]- 434.94785 218.8
[M+Na-2H]- 396.90867 177.7
[M]+ 375.93345 182.1
[M]- 375.93455 182.1
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.