CID 4226663

4-chloro-2-(2,4-dichlorobenzylideneamino)phenol

Structural Information

Molecular Formula
C13H8Cl3NO
SMILES
C1=CC(=C(C=C1Cl)Cl)C=NC2=C(C=CC(=C2)Cl)O
InChI
InChI=1S/C13H8Cl3NO/c14-9-2-1-8(11(16)5-9)7-17-12-6-10(15)3-4-13(12)18/h1-7,18H
InChIKey
IENMZNPGGKSZIL-UHFFFAOYSA-N
Compound name
4-chloro-2-[(2,4-dichlorophenyl)methylideneamino]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.96713 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.97441 161.3
[M+Na]+ 321.95635 172.5
[M-H]- 297.95985 166.6
[M+NH4]+ 317.00095 178.1
[M+K]+ 337.93029 165.0
[M+H-H2O]+ 281.96439 156.5
[M+HCOO]- 343.96533 172.1
[M+CH3COO]- 357.98098 202.3
[M+Na-2H]- 319.94180 164.8
[M]+ 298.96658 165.2
[M]- 298.96768 165.2
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.