CID 4658358

2,4-dichloro-n-(2,4-dichlorobenzylidene)aniline

Structural Information

Molecular Formula
C13H7Cl4N
SMILES
C1=CC(=C(C=C1Cl)Cl)C=NC2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C13H7Cl4N/c14-9-2-1-8(11(16)5-9)7-18-13-4-3-10(15)6-12(13)17/h1-7H
InChIKey
RRFPPNUZXMNIBU-UHFFFAOYSA-N
Compound name
N,1-bis(2,4-dichlorophenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

316.93326 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.94054 166.5
[M+Na]+ 339.92248 177.5
[M-H]- 315.92598 170.8
[M+NH4]+ 334.96708 182.6
[M+K]+ 355.89642 170.1
[M+H-H2O]+ 299.93052 161.6
[M+HCOO]- 361.93146 172.4
[M+CH3COO]- 375.94711 177.3
[M+Na-2H]- 337.90793 168.5
[M]+ 316.93271 169.8
[M]- 316.93381 169.8
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