CID 5332277

N'-(4-ethoxybenzylidene)-2-iodobenzohydrazide

Structural Information

Molecular Formula
C16H15IN2O2
SMILES
CCOC1=CC=C(C=C1)/C=N/NC(=O)C2=CC=CC=C2I
InChI
InChI=1S/C16H15IN2O2/c1-2-21-13-9-7-12(8-10-13)11-18-19-16(20)14-5-3-4-6-15(14)17/h3-11H,2H2,1H3,(H,19,20)/b18-11+
InChIKey
GHERKIAUWQOBTE-WOJGMQOQSA-N
Compound name
N-[(E)-(4-ethoxyphenyl)methylideneamino]-2-iodobenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.01782 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.02510 180.8
[M+Na]+ 417.00704 179.8
[M-H]- 393.01054 181.0
[M+NH4]+ 412.05164 191.3
[M+K]+ 432.98098 182.2
[M+H-H2O]+ 377.01508 168.1
[M+HCOO]- 439.01602 201.8
[M+CH3COO]- 453.03167 214.5
[M+Na-2H]- 414.99249 173.1
[M]+ 394.01727 179.4
[M]- 394.01837 179.4
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.