CID 45054426

N'-(3-chlorobenzylidene)-4-((4-chlorobenzyl)oxy)benzohydrazide

Structural Information

Molecular Formula
C21H16Cl2N2O2
SMILES
C1=CC(=CC(=C1)Cl)/C=N/NC(=O)C2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl
InChI
InChI=1S/C21H16Cl2N2O2/c22-18-8-4-15(5-9-18)14-27-20-10-6-17(7-11-20)21(26)25-24-13-16-2-1-3-19(23)12-16/h1-13H,14H2,(H,25,26)/b24-13+
InChIKey
PHRQSXNOZUVKCM-ZMOGYAJESA-N
Compound name
4-[(4-chlorophenyl)methoxy]-N-[(E)-(3-chlorophenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.05887 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.06615 193.0
[M+Na]+ 421.04809 200.8
[M-H]- 397.05159 202.9
[M+NH4]+ 416.09269 205.1
[M+K]+ 437.02203 193.3
[M+H-H2O]+ 381.05613 184.0
[M+HCOO]- 443.05707 209.8
[M+CH3COO]- 457.07272 224.2
[M+Na-2H]- 419.03354 196.2
[M]+ 398.05832 198.2
[M]- 398.05942 198.2
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.