CID 87656

Bis(trimethylsilyl) malonate

Structural Information

Molecular Formula
C9H20O4Si2
SMILES
C[Si](C)(C)OC(=O)CC(=O)O[Si](C)(C)C
InChI
InChI=1S/C9H20O4Si2/c1-14(2,3)12-8(10)7-9(11)13-15(4,5)6/h7H2,1-6H3
InChIKey
ATCKJLDGNXGLAO-UHFFFAOYSA-N
Compound name
bis(trimethylsilyl) propanedioate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

317
Patents

248.09001 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.097286 152.3
[M+Na]+ 271.079228 158.5
[M-H]- 247.082734 152.4
[M+NH4]+ 266.123833 171.1
[M+K]+ 287.053168 159.6
[M+H-H2O]+ 231.087270 148.1
[M+HCOO]- 293.088211 170.7
[M+CH3COO]- 307.103861 189.8
[M+Na-2H]- 269.064676 156.1
[M]+ 248.08946142 157.6
[M]- 248.09055858 157.6
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