CID 23133494

674348-00-6

Structural Information

Molecular Formula

C₅H₇ClN₂O₄S

SMILES

CC1(C(=O)NC(=O)N1)CS(=O)(=O)Cl

InChI

InChI=1S/C5H7ClN2O4S/c1-5(2-13(6,11)12)3(9)7-4(10)8-5/h2H2,1H3,(H2,7,8,9,10)

InChIKey

GXBXYLVXNQXXNV-UHFFFAOYSA-N

Compound name

(4-methyl-2,5-dioxoimidazolidin-4-yl)methanesulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 23
Patents: 225.9815 Da
Monoisotopic Mass: -0.7
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]+	226.988776	141.9
[M+Na]+	248.970718	152.2
[M-H]-	224.974224	140.9
[M+NH4]+	244.015323	161.1
[M+K]+	264.944658	147.8
[M+H-H2O]+	208.978760	138.9
[M+HCOO]-	270.979701	150.1
[M+CH3COO]-	284.995351	175.2
[M+Na-2H]-	246.956166	144.5
[M]+	225.98095142	142.8
[M]-	225.98204858	142.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe