CID 3404344

Acetic acid, 2-(4-nitrophenyl)hydrazide

Structural Information

Molecular Formula
C8H9N3O3
SMILES
CC(=O)NNC1=CC=C(C=C1)[N+](=O)[O-]
InChI
InChI=1S/C8H9N3O3/c1-6(12)9-10-7-2-4-8(5-3-7)11(13)14/h2-5,10H,1H3,(H,9,12)
InChIKey
JBEVBBJOOYCIGB-UHFFFAOYSA-N
Compound name
N'-(4-nitrophenyl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

118
Patents

195.06439 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.071666 136.7
[M+Na]+ 218.053608 142.4
[M-H]- 194.057114 140.5
[M+NH4]+ 213.098213 154.4
[M+K]+ 234.027548 137.3
[M+H-H2O]+ 178.061650 134.7
[M+HCOO]- 240.062591 164.1
[M+CH3COO]- 254.078241 181.4
[M+Na-2H]- 216.039056 145.1
[M]+ 195.06384142 133.9
[M]- 195.06493858 133.9
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