CID 132342134

Tert-butyl 4-(fluorosulfonyl)piperidine-1-carboxylate

Structural Information

Molecular Formula

C₁₀H₁₈FNO₄S

SMILES

CC(C)(C)OC(=O)N1CCC(CC1)S(=O)(=O)F

InChI

InChI=1S/C10H18FNO4S/c1-10(2,3)16-9(13)12-6-4-8(5-7-12)17(11,14)15/h8H,4-7H2,1-3H3

InChIKey

ALXDXTYJLZPTAG-UHFFFAOYSA-N

Compound name

tert-butyl 4-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

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	268.101336	157.1
[M+Na]+	290.083278	163.0
[M-H]-	266.086784	157.5
[M+NH4]+	285.127883	172.8
[M+K]+	306.057218	161.8
[M+H-H2O]+	250.091320	150.7
[M+HCOO]-	312.092261	166.8
[M+CH3COO]-	326.107911	191.0
[M+Na-2H]-	288.068726	158.7
[M]+	267.09351142	156.9
[M]-	267.09460858	156.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.