CID 135568391

P-(p-chlorobenzamido)benzoic acid 2-salicylidenehydrazide

Structural Information

Molecular Formula
C21H16ClN3O3
SMILES
C1=CC=C(C(=C1)/C=N/NC(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C21H16ClN3O3/c22-17-9-5-14(6-10-17)20(27)24-18-11-7-15(8-12-18)21(28)25-23-13-16-3-1-2-4-19(16)26/h1-13,26H,(H,24,27)(H,25,28)/b23-13+
InChIKey
QXZOTBUQCMVXIY-YDZHTSKRSA-N
Compound name
4-[(4-chlorobenzoyl)amino]-N-[(E)-(2-hydroxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

393.088 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.09528 191.8
[M+Na]+ 416.07722 197.7
[M-H]- 392.08072 201.4
[M+NH4]+ 411.12182 202.3
[M+K]+ 432.05116 191.5
[M+H-H2O]+ 376.08526 182.4
[M+HCOO]- 438.08620 212.8
[M+CH3COO]- 452.10185 225.1
[M+Na-2H]- 414.06267 195.1
[M]+ 393.08745 193.1
[M]- 393.08855 193.1
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.