CID 154867097

2743625-67-2

Structural Information

Molecular Formula
C11H19NO4S
SMILES
CC(C)(C)OC(=O)[C@]12CNC[C@H]1CS(=O)(=O)C2
InChI
InChI=1S/C11H19NO4S/c1-10(2,3)16-9(13)11-6-12-4-8(11)5-17(14,15)7-11/h8,12H,4-7H2,1-3H3/t8-,11-/m0/s1
InChIKey
UEURVELZGMYAJH-KWQFWETISA-N
Compound name
tert-butyl (3aR,6aS)-2,2-dioxo-1,3,4,5,6,6a-hexahydrothieno[3,4-c]pyrrole-3a-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

261.1035 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.11078 159.5
[M+Na]+ 284.09272 164.7
[M+NH4]+ 279.13732 168.2
[M+K]+ 300.06666 160.1
[M-H]- 260.09622 156.5
[M+Na-2H]- 282.07817 161.8
[M]+ 261.10295 159.7
[M]- 261.10405 159.7
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.