CID 46315612

1214391-35-1

Structural Information

Molecular Formula
C12H10FNO
SMILES
C1=CC(=CN=C1)C2=CC(=C(C=C2)F)CO
InChI
InChI=1S/C12H10FNO/c13-12-4-3-9(6-11(12)8-15)10-2-1-5-14-7-10/h1-7,15H,8H2
InChIKey
XRDOTYAOHWZBES-UHFFFAOYSA-N
Compound name
(2-fluoro-5-pyridin-3-ylphenyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.07465 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.08193 141.3
[M+Na]+ 226.06387 150.4
[M-H]- 202.06737 144.5
[M+NH4]+ 221.10847 158.5
[M+K]+ 242.03781 145.9
[M+H-H2O]+ 186.07191 133.0
[M+HCOO]- 248.07285 162.7
[M+CH3COO]- 262.08850 183.0
[M+Na-2H]- 224.04932 148.1
[M]+ 203.07410 139.5
[M]- 203.07520 139.5
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

No patent data available for this compound.