CID 165565612

En300-1577433

Structural Information

Molecular Formula
C11H20FNO5S
SMILES
CC(C)(C)OC(=O)N1CCOCC1CCS(=O)(=O)F
InChI
InChI=1S/C11H20FNO5S/c1-11(2,3)18-10(14)13-5-6-17-8-9(13)4-7-19(12,15)16/h9H,4-8H2,1-3H3
InChIKey
KLIMLQKXQSVLEA-UHFFFAOYSA-N
Compound name
tert-butyl 3-(2-fluorosulfonylethyl)morpholine-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.1046 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.11188 163.9
[M+Na]+ 320.09382 169.3
[M-H]- 296.09732 164.7
[M+NH4]+ 315.13842 177.0
[M+K]+ 336.06776 169.3
[M+H-H2O]+ 280.10186 157.1
[M+HCOO]- 342.10280 172.8
[M+CH3COO]- 356.11845 196.3
[M+Na-2H]- 318.07927 166.2
[M]+ 297.10405 166.0
[M]- 297.10515 166.0
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.