CID 14956351

4-[2-(thiophen-3-yl)ethyl]pyridine

Structural Information

Molecular Formula
C11H11NS
SMILES
C1=CN=CC=C1CCC2=CSC=C2
InChI
InChI=1S/C11H11NS/c1(2-11-5-8-13-9-11)10-3-6-12-7-4-10/h3-9H,1-2H2
InChIKey
BHKAZKSTQNKAPF-UHFFFAOYSA-N
Compound name
4-(2-thiophen-3-ylethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.06122 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.06850 138.8
[M+Na]+ 212.05044 147.8
[M-H]- 188.05394 144.7
[M+NH4]+ 207.09504 159.6
[M+K]+ 228.02438 144.0
[M+H-H2O]+ 172.05848 132.1
[M+HCOO]- 234.05942 158.9
[M+CH3COO]- 248.07507 152.7
[M+Na-2H]- 210.03589 142.6
[M]+ 189.06067 140.7
[M]- 189.06177 140.7
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.