CID 24708291

4-(pyrrolidine-1-carbonyl)-1,3-thiazolidine hydrochloride

Structural Information

Molecular Formula
C8H14N2OS
SMILES
C1CCN(C1)C(=O)C2CSCN2
InChI
InChI=1S/C8H14N2OS/c11-8(7-5-12-6-9-7)10-3-1-2-4-10/h7,9H,1-6H2
InChIKey
MXFNWPPVROZZOY-UHFFFAOYSA-N
Compound name
pyrrolidin-1-yl(1,3-thiazolidin-4-yl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.08269 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.08997 143.7
[M+Na]+ 209.07191 149.0
[M-H]- 185.07541 145.9
[M+NH4]+ 204.11651 163.7
[M+K]+ 225.04585 147.3
[M+H-H2O]+ 169.07995 137.0
[M+HCOO]- 231.08089 156.2
[M+CH3COO]- 245.09654 154.8
[M+Na-2H]- 207.05736 140.6
[M]+ 186.08214 138.5
[M]- 186.08324 138.5
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.