CID 23515094

1h-pyrrolo[2,3-b]pyridine-4-carboxamide

Structural Information

Molecular Formula
C8H7N3O
SMILES
C1=CNC2=NC=CC(=C21)C(=O)N
InChI
InChI=1S/C8H7N3O/c9-7(12)5-1-3-10-8-6(5)2-4-11-8/h1-4H,(H2,9,12)(H,10,11)
InChIKey
JLNLMSPUHPBAFQ-UHFFFAOYSA-N
Compound name
1H-pyrrolo[2,3-b]pyridine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

64
Patents

161.05891 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.06619 130.3
[M+Na]+ 184.04813 142.3
[M+NH4]+ 179.09273 138.1
[M+K]+ 200.02207 139.0
[M-H]- 160.05163 131.1
[M+Na-2H]- 182.03358 136.4
[M]+ 161.05836 131.9
[M]- 161.05946 131.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe