CID 154809692

4-(6-fluoropyridin-2-yl)oxan-4-ol

Structural Information

Molecular Formula

C₁₀H₁₂FNO₂

SMILES

C1COCCC1(C2=NC(=CC=C2)F)O

InChI

InChI=1S/C10H12FNO2/c11-9-3-1-2-8(12-9)10(13)4-6-14-7-5-10/h1-3,13H,4-7H2

InChIKey

VIZFZCAWISQYJB-UHFFFAOYSA-N

Compound name

4-(6-fluoro-2-pyridinyl)oxan-4-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 197.0852 Da
Monoisotopic Mass: 0.6
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]+	198.092476	140.7
[M+Na]+	220.074418	147.5
[M-H]-	196.077924	143.8
[M+NH4]+	215.119023	158.3
[M+K]+	236.048358	146.1
[M+H-H2O]+	180.082460	132.8
[M+HCOO]-	242.083401	157.8
[M+CH3COO]-	256.099051	178.4
[M+Na-2H]-	218.059866	148.0
[M]+	197.08465142	135.8
[M]-	197.08574858	135.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.