CID 52983809

2-(2-methoxyethoxy)ethane-1-sulfonyl chloride

Structural Information

Molecular Formula
C5H11ClO4S
SMILES
COCCOCCS(=O)(=O)Cl
InChI
InChI=1S/C5H11ClO4S/c1-9-2-3-10-4-5-11(6,7)8/h2-5H2,1H3
InChIKey
KOZZDLZQMLPWDR-UHFFFAOYSA-N
Compound name
2-(2-methoxyethoxy)ethanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

33
Patents

202.00665 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.013926 136.8
[M+Na]+ 224.995868 145.6
[M-H]- 200.999374 137.7
[M+NH4]+ 220.040473 157.4
[M+K]+ 240.969808 143.6
[M+H-H2O]+ 185.003910 133.3
[M+HCOO]- 247.004851 150.8
[M+CH3COO]- 261.020501 178.5
[M+Na-2H]- 222.981316 141.4
[M]+ 202.00610142 145.3
[M]- 202.00719858 145.3
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

patents stripe