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]+ 239.04964 145.2
[M+Na]+ 261.03158 155.5
[M-H]- 237.03508 144.2
[M+NH4]+ 256.07618 164.2
[M+K]+ 277.00552 152.8
[M+H-H2O]+ 221.03962 140.4
[M+HCOO]- 283.04056 157.9
[M+CH3COO]- 297.05621 183.7
[M+Na-2H]- 259.01703 146.8
[M]+ 238.04181 146.6
[M]- 238.04291 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.