CID 6366850

O-nitrocinnamoyl hydrazide

Structural Information

Molecular Formula
C9H9N3O3
SMILES
C1=CC=C(C(=C1)/C=C/C(=O)NN)[N+](=O)[O-]
InChI
InChI=1S/C9H9N3O3/c10-11-9(13)6-5-7-3-1-2-4-8(7)12(14)15/h1-6H,10H2,(H,11,13)/b6-5+
InChIKey
FDBZYDSVVLOADI-AATRIKPKSA-N
Compound name
(E)-3-(2-nitrophenyl)prop-2-enehydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

207.06439 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.071666 141.0
[M+Na]+ 230.053608 146.7
[M-H]- 206.057114 144.2
[M+NH4]+ 225.098213 158.0
[M+K]+ 246.027548 140.3
[M+H-H2O]+ 190.061650 138.9
[M+HCOO]- 252.062591 167.7
[M+CH3COO]- 266.078241 182.0
[M+Na-2H]- 228.039056 147.8
[M]+ 207.06384142 136.7
[M]- 207.06493858 136.7
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.