CID 119086843

2-ethynyl-1h-pyrrolo[2,3-b]pyridine

Structural Information

Molecular Formula
C9H6N2
SMILES
C#CC1=CC2=C(N1)N=CC=C2
InChI
InChI=1S/C9H6N2/c1-2-8-6-7-4-3-5-10-9(7)11-8/h1,3-6H,(H,10,11)
InChIKey
KASCYYRYKWOAHH-UHFFFAOYSA-N
Compound name
2-ethynyl-1H-pyrrolo[2,3-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.0531 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.06038 130.5
[M+Na]+ 165.04232 144.3
[M+NH4]+ 160.08692 135.9
[M+K]+ 181.01626 135.8
[M-H]- 141.04582 123.8
[M+Na-2H]- 163.02777 134.7
[M]+ 142.05255 129.8
[M]- 142.05365 129.8
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.