CID 59586722

1-(2-fluoropyridin-3-yl)propan-1-ol

Structural Information

Molecular Formula
C8H10FNO
SMILES
CCC(C1=C(N=CC=C1)F)O
InChI
InChI=1S/C8H10FNO/c1-2-7(11)6-4-3-5-10-8(6)9/h3-5,7,11H,2H2,1H3
InChIKey
OGZCIWSSUHWGIX-UHFFFAOYSA-N
Compound name
1-(2-fluoro-3-pyridinyl)propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

155.07465 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.081926 130.0
[M+Na]+ 178.063868 138.1
[M-H]- 154.067374 129.8
[M+NH4]+ 173.108473 149.2
[M+K]+ 194.037808 136.0
[M+H-H2O]+ 138.071910 123.1
[M+HCOO]- 200.072851 150.3
[M+CH3COO]- 214.088501 175.0
[M+Na-2H]- 176.049316 135.8
[M]+ 155.07410142 128.2
[M]- 155.07519858 128.2
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