CID 69223

Dimethyl sulfite

Structural Information

Molecular Formula
C2H6O3S
SMILES
COS(=O)OC
InChI
InChI=1S/C2H6O3S/c1-4-6(3)5-2/h1-2H3
InChIKey
BDUPRNVPXOHWIL-UHFFFAOYSA-N
Compound name
dimethyl sulfite
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

8
References

8653
Patents

110.00377 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 111.011046 115.7
[M+Na]+ 132.992988 124.4
[M-H]- 108.996494 116.9
[M+NH4]+ 128.037593 139.1
[M+K]+ 148.966928 125.4
[M+H-H2O]+ 93.001030 111.4
[M+HCOO]- 155.001971 135.1
[M+CH3COO]- 169.017621 165.0
[M+Na-2H]- 130.978436 120.1
[M]+ 110.00322142 120.5
[M]- 110.00431858 120.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe