CID 258819

Nsc88159

Structural Information

Molecular Formula

C₁₄H₁₀F₂N₂O₂

SMILES

C1=CC=C(C(=C1)C(=O)NNC(=O)C2=CC=CC=C2F)F

InChI

InChI=1S/C14H10F2N2O2/c15-11-7-3-1-5-9(11)13(19)17-18-14(20)10-6-2-4-8-12(10)16/h1-8H,(H,17,19)(H,18,20)

InChIKey

YHTGZECLQXBTHD-UHFFFAOYSA-N

Compound name

2-fluoro-N'-(2-fluorobenzoyl)benzohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 4
Patents: 276.07104 Da
Monoisotopic Mass: 2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	277.07832	158.7
[M+Na]+	299.06026	165.7
[M-H]-	275.06376	163.1
[M+NH4]+	294.10486	173.9
[M+K]+	315.03420	161.8
[M+H-H2O]+	259.06830	149.0
[M+HCOO]-	321.06924	181.9
[M+CH3COO]-	335.08489	201.9
[M+Na-2H]-	297.04571	162.4
[M]+	276.07049	154.9
[M]-	276.07159	154.9

Literature stripe

literature stripe

Patent stripe

patents stripe