CID 9639555

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

Structural Information

Molecular Formula
C29H25ClN2O3
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)C3=CC=CC=C3OCC4=CC=C(C=C4)Cl
InChI
InChI=1S/C29H25ClN2O3/c1-21-6-8-23(9-7-21)19-34-26-16-12-22(13-17-26)18-31-32-29(33)27-4-2-3-5-28(27)35-20-24-10-14-25(30)15-11-24/h2-18H,19-20H2,1H3,(H,32,33)/b31-18+
InChIKey
VKAMWTPXFMHWPY-FDAWAROLSA-N
Compound name
2-[(4-chlorophenyl)methoxy]-N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

484.15536 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 485.16264 220.5
[M+Na]+ 507.14458 225.9
[M-H]- 483.14808 233.3
[M+NH4]+ 502.18918 227.7
[M+K]+ 523.11852 218.7
[M+H-H2O]+ 467.15262 208.0
[M+HCOO]- 529.15356 240.6
[M+CH3COO]- 543.16921 243.0
[M+Na-2H]- 505.13003 221.9
[M]+ 484.15481 225.6
[M]- 484.15591 225.6
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.