CID 259098

Chembl108888

Structural Information

Molecular Formula
C18H13FN2O2
SMILES
C1=CC=C2C=C(C=CC2=C1)C(=O)NNC(=O)C3=CC=CC=C3F
InChI
InChI=1S/C18H13FN2O2/c19-16-8-4-3-7-15(16)18(23)21-20-17(22)14-10-9-12-5-1-2-6-13(12)11-14/h1-11H,(H,20,22)(H,21,23)
InChIKey
BHGKYYRQGUSTGE-UHFFFAOYSA-N
Compound name
N'-(2-fluorobenzoyl)naphthalene-2-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

308.0961 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.10338 168.5
[M+Na]+ 331.08532 174.9
[M-H]- 307.08882 174.7
[M+NH4]+ 326.12992 183.2
[M+K]+ 347.05926 170.0
[M+H-H2O]+ 291.09336 159.0
[M+HCOO]- 353.09430 191.0
[M+CH3COO]- 367.10995 209.0
[M+Na-2H]- 329.07077 174.1
[M]+ 308.09555 166.0
[M]- 308.09665 166.0
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

No patent data available for this compound.