CID 23340297

3,5,6-trifluoro-2-hydroxypyridine

Structural Information

Molecular Formula
C5H2F3NO
SMILES
C1=C(C(=O)NC(=C1F)F)F
InChI
InChI=1S/C5H2F3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)
InChIKey
PWBGZZXJAMGVGQ-UHFFFAOYSA-N
Compound name
3,5,6-trifluoro-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

149.00885 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.01613 119.1
[M+Na]+ 171.99807 131.0
[M-H]- 148.00157 117.3
[M+NH4]+ 167.04267 139.0
[M+K]+ 187.97201 127.7
[M+H-H2O]+ 132.00611 111.3
[M+HCOO]- 194.00705 139.4
[M+CH3COO]- 208.02270 172.1
[M+Na-2H]- 169.98352 125.2
[M]+ 149.00830 114.6
[M]- 149.00940 114.6
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