CID 124249469

1935910-28-3

Structural Information

Molecular Formula
C11H20N2O4S
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CS(=O)(=O)CCN2
InChI
InChI=1S/C11H20N2O4S/c1-10(2,3)17-9(14)13-6-11(7-13)8-18(15,16)5-4-12-11/h12H,4-8H2,1-3H3
InChIKey
XFEIDNKZGSDCEG-UHFFFAOYSA-N
Compound name
tert-butyl 8,8-dioxo-8lambda6-thia-2,5-diazaspiro[3.5]nonane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.11438 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.12166 161.6
[M+Na]+ 299.10360 164.3
[M+NH4]+ 294.14820 165.4
[M+K]+ 315.07754 158.4
[M-H]- 275.10710 156.7
[M+Na-2H]- 297.08905 163.4
[M]+ 276.11383 159.8
[M]- 276.11493 159.8
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.