CID 145874620

2375273-36-0

Structural Information

Molecular Formula
C10H18N2O4S
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CNS(=O)(=O)C2
InChI
InChI=1S/C10H18N2O4S/c1-9(2,3)16-8(13)12-5-10(6-12)4-11-17(14,15)7-10/h11H,4-7H2,1-3H3
InChIKey
LXRFSHKVRLSEDC-UHFFFAOYSA-N
Compound name
tert-butyl 6,6-dioxo-6lambda6-thia-2,7-diazaspiro[3.4]octane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.09872 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.10600 156.0
[M+Na]+ 285.08794 161.3
[M-H]- 261.09144 157.3
[M+NH4]+ 280.13254 169.1
[M+K]+ 301.06188 162.7
[M+H-H2O]+ 245.09598 147.1
[M+HCOO]- 307.09692 165.6
[M+CH3COO]- 321.11257 188.8
[M+Na-2H]- 283.07339 158.2
[M]+ 262.09817 165.3
[M]- 262.09927 165.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.