CID 135606633

2-((4-chlorobenzyl)oxy)-n'-(4-hydroxy-3-methoxybenzylidene)benzohydrazide

Structural Information

Molecular Formula
C22H19ClN2O4
SMILES
COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2OCC3=CC=C(C=C3)Cl)O
InChI
InChI=1S/C22H19ClN2O4/c1-28-21-12-16(8-11-19(21)26)13-24-25-22(27)18-4-2-3-5-20(18)29-14-15-6-9-17(23)10-7-15/h2-13,26H,14H2,1H3,(H,25,27)/b24-13+
InChIKey
QQBNJWQOZIUHRS-ZMOGYAJESA-N
Compound name
2-[(4-chlorophenyl)methoxy]-N-[(E)-(4-hydroxy-3-methoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

410.10333 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 411.11061 196.2
[M+Na]+ 433.09255 203.1
[M-H]- 409.09605 205.9
[M+NH4]+ 428.13715 206.7
[M+K]+ 449.06649 197.5
[M+H-H2O]+ 393.10059 186.5
[M+HCOO]- 455.10153 216.7
[M+CH3COO]- 469.11718 226.6
[M+Na-2H]- 431.07800 198.9
[M]+ 410.10278 201.5
[M]- 410.10388 201.5
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.