CID 26076432

1h-pyrrolo[3,2-c]pyridine-4-carbonitrile

Structural Information

Molecular Formula
C8H5N3
SMILES
C1=CNC2=C1C(=NC=C2)C#N
InChI
InChI=1S/C8H5N3/c9-5-8-6-1-3-10-7(6)2-4-11-8/h1-4,10H
InChIKey
KURHSTXYMIMHKH-UHFFFAOYSA-N
Compound name
1H-pyrrolo[3,2-c]pyridine-4-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

143.04834 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.05562 130.8
[M+Na]+ 166.03756 144.2
[M+NH4]+ 161.08216 136.2
[M+K]+ 182.01150 135.9
[M-H]- 142.04106 124.8
[M+Na-2H]- 164.02301 135.4
[M]+ 143.04779 130.2
[M]- 143.04889 130.2
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