CID 165869397

Tert-butyl n-ethyl-n-[2-(fluorosulfonyl)ethyl]carbamate

Structural Information

Molecular Formula
C9H18FNO4S
SMILES
CCN(CCS(=O)(=O)F)C(=O)OC(C)(C)C
InChI
InChI=1S/C9H18FNO4S/c1-5-11(6-7-16(10,13)14)8(12)15-9(2,3)4/h5-7H2,1-4H3
InChIKey
WMRZZTQPKAMHDL-UHFFFAOYSA-N
Compound name
tert-butyl N-ethyl-N-(2-fluorosulfonylethyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.09406 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.10134 154.4
[M+Na]+ 278.08328 160.6
[M-H]- 254.08678 154.7
[M+NH4]+ 273.12788 172.2
[M+K]+ 294.05722 160.8
[M+H-H2O]+ 238.09132 148.2
[M+HCOO]- 300.09226 169.6
[M+CH3COO]- 314.10791 195.9
[M+Na-2H]- 276.06873 156.6
[M]+ 255.09351 159.8
[M]- 255.09461 159.8
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.