CID 4139999

Tert-butyl 3-((methylsulfonyl)oxy)pyrrolidine-1-carboxylate

Structural Information

Molecular Formula
C10H19NO5S
SMILES
CC(C)(C)OC(=O)N1CCC(C1)OS(=O)(=O)C
InChI
InChI=1S/C10H19NO5S/c1-10(2,3)15-9(12)11-6-5-8(7-11)16-17(4,13)14/h8H,5-7H2,1-4H3
InChIKey
KWQRKOSMSFLBTJ-UHFFFAOYSA-N
Compound name
tert-butyl 3-methylsulfonyloxypyrrolidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1327
Patents

265.0984 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.105676 159.7
[M+Na]+ 288.087618 166.5
[M-H]- 264.091124 162.0
[M+NH4]+ 283.132223 177.4
[M+K]+ 304.061558 166.4
[M+H-H2O]+ 248.095660 154.8
[M+HCOO]- 310.096601 172.9
[M+CH3COO]- 324.112251 190.0
[M+Na-2H]- 286.073066 160.9
[M]+ 265.09785142 164.3
[M]- 265.09894858 164.3
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