CID 51060340

2,4-dichloro-n'-(4-((4-methylbenzyl)oxy)benzylidene)benzohydrazide

Structural Information

Molecular Formula
C22H18Cl2N2O2
SMILES
CC1=CC=C(C=C1)COC2=CC=C(C=C2)/C=N/NC(=O)C3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C22H18Cl2N2O2/c1-15-2-4-17(5-3-15)14-28-19-9-6-16(7-10-19)13-25-26-22(27)20-11-8-18(23)12-21(20)24/h2-13H,14H2,1H3,(H,26,27)/b25-13+
InChIKey
FLTFXJXRANUXPY-DHRITJCHSA-N
Compound name
2,4-dichloro-N-[(E)-[4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

412.07452 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 413.08180 197.9
[M+Na]+ 435.06374 206.1
[M-H]- 411.06724 207.9
[M+NH4]+ 430.10834 209.7
[M+K]+ 451.03768 198.5
[M+H-H2O]+ 395.07178 188.9
[M+HCOO]- 457.07272 214.4
[M+CH3COO]- 471.08837 228.3
[M+Na-2H]- 433.04919 199.8
[M]+ 412.07397 203.8
[M]- 412.07507 203.8
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.