CID 3038786

Thiazolidine, 3-(3-(5-chloro-2-pyridyl)thiopropyl)-, hydrochloride

Structural Information

Molecular Formula
C11H15ClN2S2
SMILES
C1CSCN1CCCSC2=NC=C(C=C2)Cl
InChI
InChI=1S/C11H15ClN2S2/c12-10-2-3-11(13-8-10)16-6-1-4-14-5-7-15-9-14/h2-3,8H,1,4-7,9H2
InChIKey
QICKQLIIUHOYHN-UHFFFAOYSA-N
Compound name
3-[3-(5-chloropyridin-2-yl)sulfanylpropyl]-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

274.03653 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 275.04381 156.1
[M+Na]+ 297.02575 164.8
[M-H]- 273.02925 159.9
[M+NH4]+ 292.07035 173.4
[M+K]+ 312.99969 158.8
[M+H-H2O]+ 257.03379 149.7
[M+HCOO]- 319.03473 162.0
[M+CH3COO]- 333.05038 167.2
[M+Na-2H]- 295.01120 154.5
[M]+ 274.03598 158.6
[M]- 274.03708 158.6
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.