CID 14761461

2-fluoro-3-(hydroxymethyl)pyridine

Structural Information

Molecular Formula
C6H6FNO
SMILES
C1=CC(=C(N=C1)F)CO
InChI
InChI=1S/C6H6FNO/c7-6-5(4-9)2-1-3-8-6/h1-3,9H,4H2
InChIKey
CMAIZPVYDZEAJD-UHFFFAOYSA-N
Compound name
(2-fluoro-3-pyridinyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

160
Patents

127.04334 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.050616 120.3
[M+Na]+ 150.032558 129.6
[M-H]- 126.036064 120.4
[M+NH4]+ 145.077163 140.7
[M+K]+ 166.006498 127.6
[M+H-H2O]+ 110.040600 113.8
[M+HCOO]- 172.041541 142.3
[M+CH3COO]- 186.057191 168.0
[M+Na-2H]- 148.018006 128.6
[M]+ 127.04279142 118.5
[M]- 127.04388858 118.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe