CID 3050889

2-(2,4-dichlorophenyl)-1,3-thiazolidine

Structural Information

Molecular Formula
C9H9Cl2NS
SMILES
C1CSC(N1)C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C9H9Cl2NS/c10-6-1-2-7(8(11)5-6)9-12-3-4-13-9/h1-2,5,9,12H,3-4H2
InChIKey
ZWZWFCVEHTWKIS-UHFFFAOYSA-N
Compound name
2-(2,4-dichlorophenyl)-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.98328 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.99056 146.6
[M+Na]+ 255.97250 156.2
[M-H]- 231.97600 150.4
[M+NH4]+ 251.01710 166.3
[M+K]+ 271.94644 149.6
[M+H-H2O]+ 215.98054 141.9
[M+HCOO]- 277.98148 152.9
[M+CH3COO]- 291.99713 158.7
[M+Na-2H]- 253.95795 146.3
[M]+ 232.98273 146.4
[M]- 232.98383 146.4
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.