CID 138991109

2309460-76-0

Structural Information

Molecular Formula
C10H9F2N3O
SMILES
C1=CN(N=C1)CC(C2=NC=C(C=C2)O)(F)F
InChI
InChI=1S/C10H9F2N3O/c11-10(12,7-15-5-1-4-14-15)9-3-2-8(16)6-13-9/h1-6,16H,7H2
InChIKey
LHWFJPCRKFEHMK-UHFFFAOYSA-N
Compound name
6-(1,1-difluoro-2-pyrazol-1-ylethyl)pyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.07137 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.07865 147.8
[M+Na]+ 248.06059 158.4
[M+NH4]+ 243.10519 153.2
[M+K]+ 264.03453 155.2
[M-H]- 224.06409 145.6
[M+Na-2H]- 246.04604 154.0
[M]+ 225.07082 148.4
[M]- 225.07192 148.4
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.