CID 218893

41288-03-3

Structural Information

Molecular Formula
C11H16N2OS
SMILES
C1CSCN1CCCOC2=CN=CC=C2
InChI
InChI=1S/C11H16N2OS/c1-3-11(9-12-4-1)14-7-2-5-13-6-8-15-10-13/h1,3-4,9H,2,5-8,10H2
InChIKey
CKRYUHHWBVCIDP-UHFFFAOYSA-N
Compound name
3-(3-pyridin-3-yloxypropyl)-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.09833 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.10561 149.8
[M+Na]+ 247.08755 161.1
[M+NH4]+ 242.13215 158.6
[M+K]+ 263.06149 153.6
[M-H]- 223.09105 152.7
[M+Na-2H]- 245.07300 156.3
[M]+ 224.09778 152.6
[M]- 224.09888 152.6
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.