CID 138987676

2305253-38-5

Structural Information

Molecular Formula
C14H23NO6S
SMILES
CC(C)(C)OC(=O)N1CC2(CCS(=O)(=O)CC2)CC1C(=O)O
InChI
InChI=1S/C14H23NO6S/c1-13(2,3)21-12(18)15-9-14(8-10(15)11(16)17)4-6-22(19,20)7-5-14/h10H,4-9H2,1-3H3,(H,16,17)
InChIKey
FDDBJPPBIQFKPM-UHFFFAOYSA-N
Compound name
2-[(2-methylpropan-2-yl)oxycarbonyl]-8,8-dioxo-8lambda6-thia-2-azaspiro[4.5]decane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.1246 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.13188 174.0
[M+Na]+ 356.11382 178.7
[M+NH4]+ 351.15842 180.8
[M+K]+ 372.08776 173.8
[M-H]- 332.11732 171.0
[M+Na-2H]- 354.09927 176.5
[M]+ 333.12405 174.0
[M]- 333.12515 174.0
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.