CID 77342

Ethylene sulfite

Structural Information

Molecular Formula
C2H4O3S
SMILES
C1COS(=O)O1
InChI
InChI=1S/C2H4O3S/c3-6-4-1-2-5-6/h1-2H2
InChIKey
WDXYVJKNSMILOQ-UHFFFAOYSA-N
Compound name
1,3,2-dioxathiolane 2-oxide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

2
References

13638
Patents

107.98811 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.99539 113.7
[M+Na]+ 130.97733 122.7
[M-H]- 106.98083 119.2
[M+NH4]+ 126.02193 136.3
[M+K]+ 146.95127 125.1
[M+H-H2O]+ 90.985370 110.0
[M+HCOO]- 152.98631 132.5
[M+CH3COO]- 167.00196 160.3
[M+Na-2H]- 128.96278 119.8
[M]+ 107.98756 115.9
[M]- 107.98866 115.9
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.