CID 20784462

5-fluoro-1h-pyrrolo[2,3-b]pyridine

Structural Information

Molecular Formula
C7H5FN2
SMILES
C1=CNC2=NC=C(C=C21)F
InChI
InChI=1S/C7H5FN2/c8-6-3-5-1-2-9-7(5)10-4-6/h1-4H,(H,9,10)
InChIKey
BALBNSFYMXBWNM-UHFFFAOYSA-N
Compound name
5-fluoro-1H-pyrrolo[2,3-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

460
Patents

136.04367 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.05095 120.9
[M+Na]+ 159.03289 132.3
[M-H]- 135.03639 121.0
[M+NH4]+ 154.07749 142.5
[M+K]+ 175.00683 128.5
[M+H-H2O]+ 119.04093 113.7
[M+HCOO]- 181.04187 143.2
[M+CH3COO]- 195.05752 135.4
[M+Na-2H]- 157.01834 130.1
[M]+ 136.04312 119.6
[M]- 136.04422 119.6
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