CID 163409788

Sy469297

Structural Information

Molecular Formula
C7H14N2O2S
SMILES
C1CNCCC12CNS(=O)(=O)C2
InChI
InChI=1S/C7H14N2O2S/c10-12(11)6-7(5-9-12)1-3-8-4-2-7/h8-9H,1-6H2
InChIKey
QYYIJNRBQWGFSV-UHFFFAOYSA-N
Compound name
2lambda6-thia-3,8-diazaspiro[4.5]decane 2,2-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.0776 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.08488 139.9
[M+Na]+ 213.06682 146.9
[M-H]- 189.07032 139.6
[M+NH4]+ 208.11142 161.6
[M+K]+ 229.04076 143.5
[M+H-H2O]+ 173.07486 134.8
[M+HCOO]- 235.07580 150.3
[M+CH3COO]- 249.09145 150.8
[M+Na-2H]- 211.05227 143.2
[M]+ 190.07705 133.2
[M]- 190.07815 133.2
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.