CID 167719097

8-chloro-2-fluoro-1,5-naphthyridine

Structural Information

Molecular Formula
C8H4ClFN2
SMILES
C1=CC(=NC2=C(C=CN=C21)Cl)F
InChI
InChI=1S/C8H4ClFN2/c9-5-3-4-11-6-1-2-7(10)12-8(5)6/h1-4H
InChIKey
GFHBXOLDBDVSEP-UHFFFAOYSA-N
Compound name
8-chloro-2-fluoro-1,5-naphthyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.0047 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.011976 130.3
[M+Na]+ 204.993918 142.4
[M-H]- 180.997424 131.2
[M+NH4]+ 200.038523 149.9
[M+K]+ 220.967858 137.4
[M+H-H2O]+ 165.001960 122.9
[M+HCOO]- 227.002901 146.8
[M+CH3COO]- 241.018551 144.2
[M+Na-2H]- 202.979366 140.0
[M]+ 182.00415142 131.3
[M]- 182.00524858 131.3
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

No patent data available for this compound.