CID 9643187

3-bromo-n'-[(e)-(3-nitrophenyl)methylidene]benzohydrazide

Structural Information

Molecular Formula
C14H10BrN3O3
SMILES
C1=CC(=CC(=C1)[N+](=O)[O-])/C=N/NC(=O)C2=CC(=CC=C2)Br
InChI
InChI=1S/C14H10BrN3O3/c15-12-5-2-4-11(8-12)14(19)17-16-9-10-3-1-6-13(7-10)18(20)21/h1-9H,(H,17,19)/b16-9+
InChIKey
OLBRTZVQFQYMFN-CXUHLZMHSA-N
Compound name
3-bromo-N-[(E)-(3-nitrophenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

346.99054 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.99782 169.2
[M+Na]+ 369.97976 172.6
[M+NH4]+ 365.02436 172.8
[M+K]+ 385.95370 174.2
[M-H]- 345.98326 173.2
[M+Na-2H]- 367.96521 174.0
[M]+ 346.98999 169.4
[M]- 346.99109 169.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.