CID 136300

456-07-5

Structural Information

Molecular Formula

SMILES

C1=CC(=CC=C1C(=O)NO)F

InChI

InChI=1S/C7H6FNO2/c8-6-3-1-5(2-4-6)7(10)9-11/h1-4,11H,(H,9,10)

InChIKey

TXWGRZYCKOMFFZ-UHFFFAOYSA-N

Compound name

4-fluoro-N-hydroxybenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 61
Patents: 155.03825 Da
Monoisotopic Mass: 0.4
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]+	156.045526	127.1
[M+Na]+	178.027468	135.0
[M-H]-	154.030974	128.6
[M+NH4]+	173.072073	147.1
[M+K]+	194.001408	133.1
[M+H-H2O]+	138.035510	120.8
[M+HCOO]-	200.036451	150.4
[M+CH3COO]-	214.052101	174.6
[M+Na-2H]-	176.012916	133.6
[M]+	155.03770142	124.3
[M]-	155.03879858	124.3

Literature stripe

literature stripe

Patent stripe

patents stripe