CID 46737949

6-ethynylfuro[3,2-b]pyridine

Structural Information

Molecular Formula
C9H5NO
SMILES
C#CC1=CC2=C(C=CO2)N=C1
InChI
InChI=1S/C9H5NO/c1-2-7-5-9-8(10-6-7)3-4-11-9/h1,3-6H
InChIKey
JUJFZXIEHAJRBN-UHFFFAOYSA-N
Compound name
6-ethynylfuro[3,2-b]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

143.03711 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.04439 128.1
[M+Na]+ 166.02633 142.7
[M+NH4]+ 161.07093 134.0
[M+K]+ 182.00027 134.4
[M-H]- 142.02983 123.4
[M+Na-2H]- 164.01178 132.5
[M]+ 143.03656 128.2
[M]- 143.03766 128.2
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