CID 118657414

2-methoxyethane-1-sulfinyl chloride

Structural Information

Molecular Formula

C₃H₇ClO₂S

SMILES

COCCS(=O)Cl

InChI

InChI=1S/C3H7ClO2S/c1-6-2-3-7(4)5/h2-3H2,1H3

InChIKey

CCJQEPBIDOAYEJ-UHFFFAOYSA-N

Compound name

2-methoxyethanesulfinyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 141.98553 Da
Monoisotopic Mass: 0.2
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]+	142.99281	121.6
[M+Na]+	164.97475	130.6
[M-H]-	140.97825	122.7
[M+NH4]+	160.01935	144.6
[M+K]+	180.94869	128.9
[M+H-H2O]+	124.98279	118.5
[M+HCOO]-	186.98373	136.0
[M+CH3COO]-	200.99938	169.9
[M+Na-2H]-	162.96020	125.2
[M]+	141.98498	127.0
[M]-	141.98608	127.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe