CID 89493283

4-cyano-2-fluoro-benzohydrazide

Structural Information

Molecular Formula
C8H6FN3O
SMILES
C1=CC(=C(C=C1C#N)F)C(=O)NN
InChI
InChI=1S/C8H6FN3O/c9-7-3-5(4-10)1-2-6(7)8(13)12-11/h1-3H,11H2,(H,12,13)
InChIKey
BXGFFESBJWYKEO-UHFFFAOYSA-N
Compound name
4-cyano-2-fluorobenzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

179.04948 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.056756 138.2
[M+Na]+ 202.038698 147.8
[M-H]- 178.042204 140.1
[M+NH4]+ 197.083303 155.4
[M+K]+ 218.012638 145.2
[M+H-H2O]+ 162.046740 124.8
[M+HCOO]- 224.047681 158.9
[M+CH3COO]- 238.063331 197.0
[M+Na-2H]- 200.024146 142.3
[M]+ 179.04893142 129.8
[M]- 179.05002858 129.8
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

patents stripe