CID 129919818

2-chloro-6-fluorooxazolo[5,4-b]pyridine

Structural Information

Molecular Formula
C6H2ClFN2O
SMILES
C1=C(C=NC2=C1N=C(O2)Cl)F
InChI
InChI=1S/C6H2ClFN2O/c7-6-10-4-1-3(8)2-9-5(4)11-6/h1-2H
InChIKey
YDPHOXTYYISMIZ-UHFFFAOYSA-N
Compound name
2-chloro-6-fluoro-[1,3]oxazolo[5,4-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.98396 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.99124 125.1
[M+Na]+ 194.97318 139.1
[M-H]- 170.97668 127.3
[M+NH4]+ 190.01778 145.8
[M+K]+ 210.94712 136.0
[M+H-H2O]+ 154.98122 118.4
[M+HCOO]- 216.98216 143.7
[M+CH3COO]- 230.99781 140.5
[M+Na-2H]- 192.95863 134.6
[M]+ 171.98341 129.6
[M]- 171.98451 129.6
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.