CID 13460888

1-bromoethene-1-sulfonyl fluoride

Structural Information

Molecular Formula

C₂H₂BrFO₂S

SMILES

C=C(S(=O)(=O)F)Br

InChI

InChI=1S/C2H2BrFO2S/c1-2(3)7(4,5)6/h1H2

InChIKey

CBAZRELTIGNKMX-UHFFFAOYSA-N

Compound name

1-bromoethenesulfonyl fluoride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 187.89429 Da
Monoisotopic Mass: 1.5
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]+	188.90157	117.6
[M+Na]+	210.88351	131.1
[M-H]-	186.88701	120.6
[M+NH4]+	205.92811	141.4
[M+K]+	226.85745	120.3
[M+H-H2O]+	170.89155	118.6
[M+HCOO]-	232.89249	132.8
[M+CH3COO]-	246.90814	175.2
[M+Na-2H]-	208.86896	124.1
[M]+	187.89374	136.4
[M]-	187.89484	136.4

Literature stripe

literature stripe

Patent stripe

patents stripe