CID 11008102

106757-36-2

Structural Information

Molecular Formula
C4H8O4S
SMILES
C[C@@H]1[C@H](OS(=O)(=O)O1)C
InChI
InChI=1S/C4H8O4S/c1-3-4(2)8-9(5,6)7-3/h3-4H,1-2H3/t3-,4-/m1/s1
InChIKey
POVNYOLUWDFQOZ-QWWZWVQMSA-N
Compound name
(4R,5R)-4,5-dimethyl-1,3,2-dioxathiolane 2,2-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

93
Patents

152.01433 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.021606 121.5
[M+Na]+ 175.003548 132.2
[M-H]- 151.007054 127.6
[M+NH4]+ 170.048153 144.8
[M+K]+ 190.977488 134.1
[M+H-H2O]+ 135.011590 119.0
[M+HCOO]- 197.012531 139.9
[M+CH3COO]- 211.028181 169.5
[M+Na-2H]- 172.988996 127.3
[M]+ 152.01378142 126.4
[M]- 152.01487858 126.4
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