CID 9659726

N'-(4-(benzyloxy)-3-methoxybenzylidene)-2-iodobenzohydrazide

Structural Information

Molecular Formula
C22H19IN2O3
SMILES
COC1=C(C=CC(=C1)/C=N/NC(=O)C2=CC=CC=C2I)OCC3=CC=CC=C3
InChI
InChI=1S/C22H19IN2O3/c1-27-21-13-17(11-12-20(21)28-15-16-7-3-2-4-8-16)14-24-25-22(26)18-9-5-6-10-19(18)23/h2-14H,15H2,1H3,(H,25,26)/b24-14+
InChIKey
AJSFZXLJVUFHRC-ZVHZXABRSA-N
Compound name
2-iodo-N-[(E)-(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

486.04404 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 487.05132 206.3
[M+Na]+ 509.03326 204.5
[M-H]- 485.03676 208.8
[M+NH4]+ 504.07786 212.6
[M+K]+ 525.00720 205.9
[M+H-H2O]+ 469.04130 191.4
[M+HCOO]- 531.04224 226.4
[M+CH3COO]- 545.05789 230.6
[M+Na-2H]- 507.01871 197.5
[M]+ 486.04349 205.7
[M]- 486.04459 205.7
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.