CID 131125296

Tert-butyl 3-(fluorosulfonyl)piperidine-1-carboxylate

Structural Information

Molecular Formula
C10H18FNO4S
SMILES
CC(C)(C)OC(=O)N1CCCC(C1)S(=O)(=O)F
InChI
InChI=1S/C10H18FNO4S/c1-10(2,3)16-9(13)12-6-4-5-8(7-12)17(11,14)15/h8H,4-7H2,1-3H3
InChIKey
KGUFPZQZPDWHAW-UHFFFAOYSA-N
Compound name
tert-butyl 3-fluorosulfonylpiperidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.09406 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.10134 157.1
[M+Na]+ 290.08328 163.0
[M-H]- 266.08678 157.5
[M+NH4]+ 285.12788 172.8
[M+K]+ 306.05722 161.8
[M+H-H2O]+ 250.09132 150.7
[M+HCOO]- 312.09226 166.8
[M+CH3COO]- 326.10791 191.0
[M+Na-2H]- 288.06873 158.7
[M]+ 267.09351 156.9
[M]- 267.09461 156.9
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.