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]+ 229.02959 144.4
[M+Na]+ 251.01153 152.9
[M-H]- 227.01503 148.9
[M+NH4]+ 246.05613 166.2
[M+K]+ 266.98547 151.8
[M+H-H2O]+ 211.01957 141.9
[M+HCOO]- 273.02051 156.7
[M+CH3COO]- 287.03616 180.1
[M+Na-2H]- 248.99698 149.4
[M]+ 228.02176 150.3
[M]- 228.02286 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.