CID 165985241

[3-(methoxymethyl)oxolan-3-yl]methanesulfonyl chloride

Structural Information

Molecular Formula
C7H13ClO4S
SMILES
COCC1(CCOC1)CS(=O)(=O)Cl
InChI
InChI=1S/C7H13ClO4S/c1-11-4-7(2-3-12-5-7)6-13(8,9)10/h2-6H2,1H3
InChIKey
KVDYLTZOOFZOFW-UHFFFAOYSA-N
Compound name
[3-(methoxymethyl)oxolan-3-yl]methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.02231 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.029586 144.4
[M+Na]+ 251.011528 152.9
[M-H]- 227.015034 148.9
[M+NH4]+ 246.056133 166.2
[M+K]+ 266.985468 151.8
[M+H-H2O]+ 211.019570 141.9
[M+HCOO]- 273.020511 156.7
[M+CH3COO]- 287.036161 180.1
[M+Na-2H]- 248.996976 149.4
[M]+ 228.02176142 150.3
[M]- 228.02285858 150.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.