CID 165735735

2169164-71-8

Structural Information

Molecular Formula
C9H16FNO4S
SMILES
CC(C)(C)OC(=O)N1CCC1CS(=O)(=O)F
InChI
InChI=1S/C9H16FNO4S/c1-9(2,3)15-8(12)11-5-4-7(11)6-16(10,13)14/h7H,4-6H2,1-3H3
InChIKey
GQNVUSVLPSWRGZ-UHFFFAOYSA-N
Compound name
tert-butyl 2-(fluorosulfonylmethyl)azetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

253.07841 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.08569 151.8
[M+Na]+ 276.06763 156.7
[M-H]- 252.07113 152.3
[M+NH4]+ 271.11223 161.3
[M+K]+ 292.04157 158.9
[M+H-H2O]+ 236.07567 139.6
[M+HCOO]- 298.07661 162.4
[M+CH3COO]- 312.09226 192.6
[M+Na-2H]- 274.05308 153.0
[M]+ 253.07786 162.9
[M]- 253.07896 162.9
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.