CID 6367163

Brn 5674469

Structural Information

Molecular Formula
C30H35O6Si
SMILES
CCOC(=O)CCC(C1=CC=CC=C1)O[Si](C2=CC=CC=C2)OC(CCC(=O)OCC)C3=CC=CC=C3
InChI
InChI=1S/C30H35O6Si/c1-3-33-29(31)22-20-27(24-14-8-5-9-15-24)35-37(26-18-12-7-13-19-26)36-28(21-23-30(32)34-4-2)25-16-10-6-11-17-25/h5-19,27-28H,3-4,20-23H2,1-2H3
InChIKey
WHCKFWSNRDLZIY-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

519.2203 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 520.22758 229.7
[M+Na]+ 542.20952 227.9
[M-H]- 518.21302 236.2
[M+NH4]+ 537.25412 233.7
[M+K]+ 558.18346 225.5
[M+H-H2O]+ 502.21756 217.4
[M+HCOO]- 564.21850 245.5
[M+CH3COO]- 578.23415 241.3
[M+Na-2H]- 540.19497 225.1
[M]+ 519.21975 235.0
[M]- 519.22085 235.0
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.