CID 16227105

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)ethane-1-sulfonyl fluoride

Structural Information

Molecular Formula
C7H11FN2O4S
SMILES
CC1(C(=O)N(C(=O)N1)CCS(=O)(=O)F)C
InChI
InChI=1S/C7H11FN2O4S/c1-7(2)5(11)10(6(12)9-7)3-4-15(8,13)14/h3-4H2,1-2H3,(H,9,12)
InChIKey
FYKCZPQVZFNDCD-UHFFFAOYSA-N
Compound name
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)ethanesulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.04236 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.049636 145.2
[M+Na]+ 261.031578 155.5
[M-H]- 237.035084 144.2
[M+NH4]+ 256.076183 164.2
[M+K]+ 277.005518 152.8
[M+H-H2O]+ 221.039620 140.4
[M+HCOO]- 283.040561 157.9
[M+CH3COO]- 297.056211 183.7
[M+Na-2H]- 259.017026 146.8
[M]+ 238.04181142 146.6
[M]- 238.04290858 146.6
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.