CID 15084146

132464-90-5

Structural Information

Molecular Formula
C11H7NS
SMILES
C#CC1=CC=C(S1)C2=CC=CC=N2
InChI
InChI=1S/C11H7NS/c1-2-9-6-7-11(13-9)10-5-3-4-8-12-10/h1,3-8H
InChIKey
CTZZEBNNWDVUFO-UHFFFAOYSA-N
Compound name
2-(5-ethynylthiophen-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

185.02992 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.03720 135.2
[M+Na]+ 208.01914 149.1
[M+NH4]+ 203.06374 141.7
[M+K]+ 223.99308 138.4
[M-H]- 184.02264 131.4
[M+Na-2H]- 206.00459 141.1
[M]+ 185.02937 135.9
[M]- 185.03047 135.9
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