CID 132342232

2137886-32-7

Structural Information

Molecular Formula
C6H2ClF2NO2
SMILES
C1=CC(=NC2=C1OC(O2)(F)F)Cl
InChI
InChI=1S/C6H2ClF2NO2/c7-4-2-1-3-5(10-4)12-6(8,9)11-3/h1-2H
InChIKey
NQGVDNWGQUWGNF-UHFFFAOYSA-N
Compound name
5-chloro-2,2-difluoro-[1,3]dioxolo[4,5-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.97421 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.98149 132.2
[M+Na]+ 215.96343 144.6
[M+NH4]+ 211.00803 141.3
[M+K]+ 231.93737 139.3
[M-H]- 191.96693 133.2
[M+Na-2H]- 213.94888 137.4
[M]+ 192.97366 134.6
[M]- 192.97476 134.6
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

No patent data available for this compound.