CID 59218601

946578-33-2

Structural Information

Molecular Formula
C7H7F2NO
SMILES
C1=CC(=NC=C1CO)C(F)F
InChI
InChI=1S/C7H7F2NO/c8-7(9)6-2-1-5(4-11)3-10-6/h1-3,7,11H,4H2
InChIKey
PMGVOPYAMVOKIH-UHFFFAOYSA-N
Compound name
[6-(difluoromethyl)pyridin-3-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

145
Patents

159.04958 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.05686 131.6
[M+Na]+ 182.03880 142.4
[M+NH4]+ 177.08340 138.3
[M+K]+ 198.01274 137.0
[M-H]- 158.04230 129.8
[M+Na-2H]- 180.02425 136.9
[M]+ 159.04903 132.3
[M]- 159.05013 132.3
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