CID 165868876

Tert-butyln-[2-(fluorosulfonyl)ethyl]carbamate

Structural Information

Molecular Formula
C7H14FNO4S
SMILES
CC(C)(C)OC(=O)NCCS(=O)(=O)F
InChI
InChI=1S/C7H14FNO4S/c1-7(2,3)13-6(10)9-4-5-14(8,11)12/h4-5H2,1-3H3,(H,9,10)
InChIKey
MSOZIBCBJCVHQV-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-fluorosulfonylethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

227.06276 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 228.07004 146.4
[M+Na]+ 250.05198 153.3
[M-H]- 226.05548 145.6
[M+NH4]+ 245.09658 164.7
[M+K]+ 266.02592 152.5
[M+H-H2O]+ 210.06002 140.7
[M+HCOO]- 272.06096 161.8
[M+CH3COO]- 286.07661 186.4
[M+Na-2H]- 248.03743 150.1
[M]+ 227.06221 149.8
[M]- 227.06331 149.8
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.