CID 64197959

2-[2-(2-methoxyethoxy)ethoxy]ethane-1-sulfonyl chloride

Structural Information

Molecular Formula

C₇H₁₅ClO₅S

SMILES

COCCOCCOCCS(=O)(=O)Cl

InChI

InChI=1S/C7H15ClO5S/c1-11-2-3-12-4-5-13-6-7-14(8,9)10/h2-7H2,1H3

InChIKey

MOWNETJQZGGNTN-UHFFFAOYSA-N

Compound name

2-[2-(2-methoxyethoxy)ethoxy]ethanesulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 246.03287 Da
Monoisotopic Mass: -0.1
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]+	247.040146	148.3
[M+Na]+	269.022088	156.1
[M-H]-	245.025594	148.8
[M+NH4]+	264.066693	167.0
[M+K]+	284.996028	154.0
[M+H-H2O]+	229.030130	144.2
[M+HCOO]-	291.031071	162.0
[M+CH3COO]-	305.046721	186.4
[M+Na-2H]-	267.007536	152.2
[M]+	246.03232142	159.0
[M]-	246.03341858	159.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe