CID 120770

2-(2-thiazolidinyl)pyridine

Structural Information

Molecular Formula

C₈H₁₀N₂S

SMILES

C1CSC(N1)C2=CC=CC=N2

InChI

InChI=1S/C8H10N2S/c1-2-4-9-7(3-1)8-10-5-6-11-8/h1-4,8,10H,5-6H2

InChIKey

VQRXHIVVUXYAFH-UHFFFAOYSA-N

Compound name

2-pyridin-2-yl-1,3-thiazolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 27
Patents: 166.05647 Da
Monoisotopic Mass: 0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	167.06375	132.8
[M+Na]+	189.04569	140.5
[M-H]-	165.04919	135.5
[M+NH4]+	184.09029	152.2
[M+K]+	205.01963	136.9
[M+H-H2O]+	149.05373	125.8
[M+HCOO]-	211.05467	148.2
[M+CH3COO]-	225.07032	145.3
[M+Na-2H]-	187.03114	135.5
[M]+	166.05592	129.4
[M]-	166.05702	129.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe