CID 12903

Benzoic acid, p-fluoro-, benzoylhydrazide

Structural Information

Molecular Formula

C₁₄H₁₁FN₂O₂

SMILES

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

InChI

InChI=1S/C14H11FN2O2/c15-12-8-6-11(7-9-12)14(19)17-16-13(18)10-4-2-1-3-5-10/h1-9H,(H,16,18)(H,17,19)

InChIKey

KHQUUZWSHWTLKE-UHFFFAOYSA-N

Compound name

N'-benzoyl-4-fluorobenzohydrazide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1
Patents: 258.08044 Da
Monoisotopic Mass: 1.8
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]+	259.08772	157.3
[M+Na]+	281.06966	168.5
[M+NH4]+	276.11426	164.1
[M+K]+	297.04360	162.3
[M-H]-	257.07316	160.4
[M+Na-2H]-	279.05511	165.4
[M]+	258.07989	159.4
[M]-	258.08099	159.4

Literature stripe

literature stripe

Patent stripe

patents stripe