CID 3693744

4-nitrobenzohydrazide

Structural Information

Molecular Formula
C7H7N3O3
SMILES
C1=CC(=CC=C1C(=O)NN)[N+](=O)[O-]
InChI
InChI=1S/C7H7N3O3/c8-9-7(11)5-1-3-6(4-2-5)10(12)13/h1-4H,8H2,(H,9,11)
InChIKey
FKZXYJYTUSGIQE-UHFFFAOYSA-N
Compound name
4-nitrobenzohydrazide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

23
References

651
Patents

181.04874 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.05602 133.8
[M+Na]+ 204.03796 144.5
[M+NH4]+ 199.08256 140.9
[M+K]+ 220.01190 142.9
[M-H]- 180.04146 137.0
[M+Na-2H]- 202.02341 139.6
[M]+ 181.04819 135.7
[M]- 181.04929 135.7
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

patents stripe