CID 9690016

Isonicotinoyl hydrazone of 2,6-dichlorobenzaldehyde

Structural Information

Molecular Formula
C13H9Cl2N3O
SMILES
C1=CC(=C(C=C1Cl)/C=N/NC(=O)C2=CC=NC=C2)Cl
InChI
InChI=1S/C13H9Cl2N3O/c14-11-1-2-12(15)10(7-11)8-17-18-13(19)9-3-5-16-6-4-9/h1-8H,(H,18,19)/b17-8+
InChIKey
CJNSSBYLUNJYEV-CAOOACKPSA-N
Compound name
N-[(E)-(2,5-dichlorophenyl)methylideneamino]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

293.01227 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.01955 162.8
[M+Na]+ 316.00149 171.9
[M-H]- 292.00499 168.8
[M+NH4]+ 311.04609 178.2
[M+K]+ 331.97543 165.6
[M+H-H2O]+ 276.00953 155.3
[M+HCOO]- 338.01047 179.5
[M+CH3COO]- 352.02612 204.2
[M+Na-2H]- 313.98694 168.6
[M]+ 293.01172 166.0
[M]- 293.01282 166.0
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

patents stripe