CID 10909753

(4r)-4-ethyl-1,3,2lambda6-dioxathiolane-2,2-dione

Structural Information

Molecular Formula
C4H8O4S
SMILES
CC[C@@H]1COS(=O)(=O)O1
InChI
InChI=1S/C4H8O4S/c1-2-4-3-7-9(5,6)8-4/h4H,2-3H2,1H3/t4-/m1/s1
InChIKey
LHSIBZSEORSTMG-SCSAIBSYSA-N
Compound name
(4R)-4-ethyl-1,3,2-dioxathiolane 2,2-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

152.01433 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.021606 122.6
[M+Na]+ 175.003548 132.5
[M-H]- 151.007054 128.3
[M+NH4]+ 170.048153 145.6
[M+K]+ 190.977488 134.4
[M+H-H2O]+ 135.011590 119.8
[M+HCOO]- 197.012531 141.1
[M+CH3COO]- 211.028181 168.3
[M+Na-2H]- 172.988996 128.9
[M]+ 152.01378142 127.1
[M]- 152.01487858 127.1
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