CID 2778022

120801-75-4

Structural Information

Molecular Formula

C₅H₉F₃O₄SSi

SMILES

C[Si](C)(C)OC(=O)C(F)(F)S(=O)(=O)F

InChI

InChI=1S/C5H9F3O4SSi/c1-14(2,3)12-4(9)5(6,7)13(8,10)11/h1-3H3

InChIKey

XHVSCKNABCCCAC-UHFFFAOYSA-N

Compound name

trimethylsilyl 2,2-difluoro-2-fluorosulfonylacetate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 3
References: 578
Patents: 249.9943 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	251.00158	157.6
[M+Na]+	272.98352	162.0
[M+NH4]+	268.02812	160.3
[M+K]+	288.95746	159.1
[M-H]-	248.98702	149.1
[M+Na-2H]-	270.96897	156.1
[M]+	249.99375	155.7
[M]-	249.99485	155.7

Literature stripe

literature stripe

Patent stripe

patents stripe