CID 102103426

1453315-76-8

Structural Information

Molecular Formula
C11H20N2O4S
SMILES
CC(C)(C)OC(=O)N1CC2(C1)CC(CS2(=O)=O)N
InChI
InChI=1S/C11H20N2O4S/c1-10(2,3)17-9(14)13-6-11(7-13)4-8(12)5-18(11,15)16/h8H,4-7,12H2,1-3H3
InChIKey
HIXKKZAKBLIEPB-UHFFFAOYSA-N
Compound name
tert-butyl 7-amino-5,5-dioxo-5lambda6-thia-2-azaspiro[3.4]octane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

276.11438 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.12166 163.3
[M+Na]+ 299.10360 164.5
[M+NH4]+ 294.14820 167.4
[M+K]+ 315.07754 160.7
[M-H]- 275.10710 159.0
[M+Na-2H]- 297.08905 164.2
[M]+ 276.11383 161.3
[M]- 276.11493 161.3
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

patents stripe