CID 137943726

2287300-70-1

Structural Information

Molecular Formula
C9H17FN2O4S
SMILES
CC(C)(C)OC(=O)NCC1CN(C1)S(=O)(=O)F
InChI
InChI=1S/C9H17FN2O4S/c1-9(2,3)16-8(13)11-4-7-5-12(6-7)17(10,14)15/h7H,4-6H2,1-3H3,(H,11,13)
InChIKey
WNZNXVGFNRGAJC-UHFFFAOYSA-N
Compound name
tert-butyl N-[(1-fluorosulfonylazetidin-3-yl)methyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.0893 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.09658 157.7
[M+Na]+ 291.07852 161.3
[M-H]- 267.08202 157.8
[M+NH4]+ 286.12312 166.0
[M+K]+ 307.05246 163.4
[M+H-H2O]+ 251.08656 144.4
[M+HCOO]- 313.08750 169.0
[M+CH3COO]- 327.10315 197.4
[M+Na-2H]- 289.06397 159.0
[M]+ 268.08875 167.7
[M]- 268.08985 167.7
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.