CID 5046716

N-(2-chlorobenzylidene)-2,3-dichloroaniline

Structural Information

Molecular Formula
C13H8Cl3N
SMILES
C1=CC=C(C(=C1)C=NC2=C(C(=CC=C2)Cl)Cl)Cl
InChI
InChI=1S/C13H8Cl3N/c14-10-5-2-1-4-9(10)8-17-12-7-3-6-11(15)13(12)16/h1-8H
InChIKey
NOBSIHFEHVSNSW-UHFFFAOYSA-N
Compound name
1-(2-chlorophenyl)-N-(2,3-dichlorophenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

282.97223 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.97951 159.5
[M+Na]+ 305.96145 177.4
[M+NH4]+ 301.00605 169.9
[M+K]+ 321.93539 166.3
[M-H]- 281.96495 165.5
[M+Na-2H]- 303.94690 170.2
[M]+ 282.97168 164.9
[M]- 282.97278 164.9
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

patents stripe