CID 9632144

2-((4-chlorobenzyl)oxy)-n'-(4-((4-chlorobenzyl)oxy)benzylidene)benzohydrazide

Structural Information

Molecular Formula
C28H22Cl2N2O3
SMILES
C1=CC=C(C(=C1)C(=O)N/N=C/C2=CC=C(C=C2)OCC3=CC=C(C=C3)Cl)OCC4=CC=C(C=C4)Cl
InChI
InChI=1S/C28H22Cl2N2O3/c29-23-11-5-21(6-12-23)18-34-25-15-9-20(10-16-25)17-31-32-28(33)26-3-1-2-4-27(26)35-19-22-7-13-24(30)14-8-22/h1-17H,18-19H2,(H,32,33)/b31-17+
InChIKey
VWPQYHXNHPQBEN-KBVAKVRCSA-N
Compound name
2-[(4-chlorophenyl)methoxy]-N-[(E)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

504.10074 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 505.10802 221.7
[M+Na]+ 527.08996 228.1
[M-H]- 503.09346 233.8
[M+NH4]+ 522.13456 228.8
[M+K]+ 543.06390 220.2
[M+H-H2O]+ 487.09800 210.1
[M+HCOO]- 549.09894 237.2
[M+CH3COO]- 563.11459 229.5
[M+Na-2H]- 525.07541 223.0
[M]+ 504.10019 228.4
[M]- 504.10129 228.4
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.