CID 119096653

18163-71-8

Structural Information

Molecular Formula
C5H10O2SSi
SMILES
C[Si]1(CSCC(=O)O1)C
InChI
InChI=1S/C5H10O2SSi/c1-9(2)4-8-3-5(6)7-9/h3-4H2,1-2H3
InChIKey
GQBYMAJHDVRWAI-UHFFFAOYSA-N
Compound name
2,2-dimethyl-1,4,2-oxathiasilinan-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

58
Patents

162.01707 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.02435 127.1
[M+Na]+ 185.00629 134.7
[M-H]- 161.00979 131.5
[M+NH4]+ 180.05089 149.7
[M+K]+ 200.98023 135.1
[M+H-H2O]+ 145.01433 122.9
[M+HCOO]- 207.01527 142.8
[M+CH3COO]- 221.03092 171.2
[M+Na-2H]- 182.99174 132.3
[M]+ 162.01652 127.3
[M]- 162.01762 127.3
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