CID 3038784

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

Structural Information

Molecular Formula
C11H14Cl2N2S2
SMILES
C1CSCN1CCCSC2=C(C=C(C=N2)Cl)Cl
InChI
InChI=1S/C11H14Cl2N2S2/c12-9-6-10(13)11(14-7-9)17-4-1-2-15-3-5-16-8-15/h6-7H,1-5,8H2
InChIKey
GEBGPFOLUUXPIW-UHFFFAOYSA-N
Compound name
3-[3-(3,5-dichloropyridin-2-yl)sulfanylpropyl]-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.99756 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.00484 162.1
[M+Na]+ 330.98678 171.4
[M-H]- 306.99028 165.6
[M+NH4]+ 326.03138 178.6
[M+K]+ 346.96072 164.7
[M+H-H2O]+ 290.99482 156.4
[M+HCOO]- 352.99576 162.9
[M+CH3COO]- 367.01141 172.6
[M+Na-2H]- 328.97223 159.1
[M]+ 307.99701 165.5
[M]- 307.99811 165.5
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.