CID 10994280

2,3,4,6-tetrakis-o-trimethylsilyl-d-gluconolactone

Structural Information

Molecular Formula
C18H42O6Si4
SMILES
C[Si](C)(C)OC[C@@H]1[C@H]([C@@H]([C@H](C(=O)O1)O[Si](C)(C)C)O[Si](C)(C)C)O[Si](C)(C)C
InChI
InChI=1S/C18H42O6Si4/c1-25(2,3)20-13-14-15(22-26(4,5)6)16(23-27(7,8)9)17(18(19)21-14)24-28(10,11)12/h14-17H,13H2,1-12H3/t14-,15-,16+,17-/m1/s1
InChIKey
VNGTZLYNGGLPIZ-WCXIOVBPSA-N
Compound name
(3R,4S,5R,6R)-3,4,5-tris(trimethylsilyloxy)-6-(trimethylsilyloxymethyl)oxan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

421
Patents

466.20584 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 467.21312 201.5
[M+Na]+ 489.19506 205.1
[M-H]- 465.19856 204.4
[M+NH4]+ 484.23966 211.9
[M+K]+ 505.16900 207.3
[M+H-H2O]+ 449.20310 196.3
[M+HCOO]- 511.20404 211.4
[M+CH3COO]- 525.21969 230.7
[M+Na-2H]- 487.18051 204.5
[M]+ 466.20529 210.2
[M]- 466.20639 210.3
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