CID 165362808

Dtxsid901021480

Structural Information

Molecular Formula
C13H24O13Si
SMILES
C([C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O[Si]C(O)O)O)O)O)O
InChI
InChI=1S/C13H24O13Si/c14-1-3-5(16)7(18)9(20)11(23-3)25-12-10(26-27-13(21)22)8(19)6(17)4(2-15)24-12/h3-22H,1-2H2/t3-,4-,5-,6-,7+,8+,9-,10-,11-,12-/m1/s1
InChIKey
GTYQJXDMSCXYBX-LIZSDCNHSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

416.0986 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.10588 187.2
[M+Na]+ 439.08782 188.0
[M-H]- 415.09132 182.6
[M+NH4]+ 434.13242 189.0
[M+K]+ 455.06176 190.2
[M+H-H2O]+ 399.09586 179.9
[M+HCOO]- 461.09680 188.2
[M+CH3COO]- 475.11245 210.0
[M+Na-2H]- 437.07327 182.6
[M]+ 416.09805 185.0
[M]- 416.09915 185.0
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

No patent data available for this compound.