CID 138987510

2305252-60-0

Structural Information

Molecular Formula
C6H11NO3S
SMILES
C1CC2(C1)CNS(=O)(=O)OC2
InChI
InChI=1S/C6H11NO3S/c8-11(9)7-4-6(5-10-11)2-1-3-6/h7H,1-5H2
InChIKey
ILZRRJJKJJSYGJ-UHFFFAOYSA-N
Compound name
6-oxa-7lambda6-thia-8-azaspiro[3.5]nonane 7,7-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

177.04596 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.05324 125.8
[M+Na]+ 200.03518 131.3
[M-H]- 176.03868 128.9
[M+NH4]+ 195.07978 140.3
[M+K]+ 216.00912 133.8
[M+H-H2O]+ 160.04322 116.3
[M+HCOO]- 222.04416 137.5
[M+CH3COO]- 236.05981 173.5
[M+Na-2H]- 198.02063 132.9
[M]+ 177.04541 132.0
[M]- 177.04651 132.0
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.