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]+ 180.05676 138.2
[M+Na]+ 202.03870 147.8
[M-H]- 178.04220 140.1
[M+NH4]+ 197.08330 155.4
[M+K]+ 218.01264 145.2
[M+H-H2O]+ 162.04674 124.8
[M+HCOO]- 224.04768 158.9
[M+CH3COO]- 238.06333 197.0
[M+Na-2H]- 200.02415 142.3
[M]+ 179.04893 129.8
[M]- 179.05003 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