CID 93958187

2377004-37-8

Structural Information

Molecular Formula
C8H16N2O2S
SMILES
C1C[C@@H](NC1)CN2CCCS2(=O)=O
InChI
InChI=1S/C8H16N2O2S/c11-13(12)6-2-5-10(13)7-8-3-1-4-9-8/h8-9H,1-7H2/t8-/m1/s1
InChIKey
DBCBCWLZNXYBAF-MRVPVSSYSA-N
Compound name
2-[[(2R)-pyrrolidin-2-yl]methyl]-1,2-thiazolidine 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.09325 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.10053 146.3
[M+Na]+ 227.08247 153.7
[M+NH4]+ 222.12707 155.0
[M+K]+ 243.05641 148.8
[M-H]- 203.08597 146.4
[M+Na-2H]- 225.06792 149.9
[M]+ 204.09270 147.5
[M]- 204.09380 147.5
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.