CID 5335250

4-chloro-n'-(4-nitrobenzylidene)benzohydrazide

Structural Information

Molecular Formula
C14H10ClN3O3
SMILES
C1=CC(=CC=C1/C=N/NC(=O)C2=CC=C(C=C2)Cl)[N+](=O)[O-]
InChI
InChI=1S/C14H10ClN3O3/c15-12-5-3-11(4-6-12)14(19)17-16-9-10-1-7-13(8-2-10)18(20)21/h1-9H,(H,17,19)/b16-9+
InChIKey
LPQOFQBGRVLXJA-CXUHLZMHSA-N
Compound name
4-chloro-N-[(E)-(4-nitrophenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

303.04108 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.04836 166.6
[M+Na]+ 326.03030 172.7
[M-H]- 302.03380 174.2
[M+NH4]+ 321.07490 181.0
[M+K]+ 342.00424 164.2
[M+H-H2O]+ 286.03834 163.4
[M+HCOO]- 348.03928 190.3
[M+CH3COO]- 362.05493 201.3
[M+Na-2H]- 324.01575 173.4
[M]+ 303.04053 167.1
[M]- 303.04163 167.1
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.