CID 3041368

54014-09-4

Structural Information

Molecular Formula

C₉H₇FN₂O₂

SMILES

C1=CC(=CC=C1C2=NN=C(O2)CO)F

InChI

InChI=1S/C9H7FN2O2/c10-7-3-1-6(2-4-7)9-12-11-8(5-13)14-9/h1-4,13H,5H2

InChIKey

JYOQFQRZPKMZNH-UHFFFAOYSA-N

Compound name

[5-(4-fluorophenyl)-1,3,4-oxadiazol-2-yl]methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 194.04915 Da
Monoisotopic Mass: 0.7
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]+	195.05643	139.4
[M+Na]+	217.03837	152.4
[M+NH4]+	212.08297	146.4
[M+K]+	233.01231	148.8
[M-H]-	193.04187	141.2
[M+Na-2H]-	215.02382	146.1
[M]+	194.04860	141.6
[M]-	194.04970	141.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe