CID 135568400

Brn 4579144

Structural Information

Molecular Formula
C22H20ClN3O3
SMILES
CC1=CC(=CC=C1)NC2=C(C=CC(=C2)Cl)C(=O)N/N=C/C3=CC(=C(C=C3)O)OC
InChI
InChI=1S/C22H20ClN3O3/c1-14-4-3-5-17(10-14)25-19-12-16(23)7-8-18(19)22(28)26-24-13-15-6-9-20(27)21(11-15)29-2/h3-13,25,27H,1-2H3,(H,26,28)/b24-13+
InChIKey
BHOSODVXZXMYEM-ZMOGYAJESA-N
Compound name
4-chloro-N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]-2-(3-methylanilino)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

409.11932 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.12660 199.5
[M+Na]+ 432.10854 213.9
[M+NH4]+ 427.15314 206.2
[M+K]+ 448.08248 205.0
[M-H]- 408.11204 207.0
[M+Na-2H]- 430.09399 209.0
[M]+ 409.11877 203.9
[M]- 409.11987 203.9
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

No patent data available for this compound.