CID 69476595

2-(6-fluoropyridin-3-yl)propan-2-ol

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

155.07465 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 156.08193 130.1
[M+Na]+ 178.06387 139.0
[M-H]- 154.06737 130.3
[M+NH4]+ 173.10847 149.6
[M+K]+ 194.03781 136.9
[M+H-H2O]+ 138.07191 123.9
[M+HCOO]- 200.07285 149.8
[M+CH3COO]- 214.08850 174.4
[M+Na-2H]- 176.04932 137.8
[M]+ 155.07410 128.5
[M]- 155.07520 128.5
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