CID 3080374

2,8,9-trioxa-5-aza-1-silabicyclo(3.3.3)undecane, 1-(4-((trimethylsilyl)ethynyl)phenyl)-

Structural Information

Molecular Formula
C17H25NO3Si2
SMILES
C[Si](C)(C)C#CC1=CC=C(C=C1)[Si]23OCCN(CCO2)CCO3
InChI
InChI=1S/C17H25NO3Si2/c1-22(2,3)15-8-16-4-6-17(7-5-16)23-19-12-9-18(10-13-20-23)11-14-21-23/h4-7H,9-14H2,1-3H3
InChIKey
BLHIGMFSXHJXKF-UHFFFAOYSA-N
Compound name
trimethyl-[2-[4-(2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecan-1-yl)phenyl]ethynyl]silane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

347.1373 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.14458 169.9
[M+Na]+ 370.12652 169.9
[M+NH4]+ 365.17112 169.9
[M+K]+ 386.10046 169.9
[M-H]- 346.13002 169.9
[M+Na-2H]- 368.11197 169.9
[M]+ 347.13675 169.9
[M]- 347.13785 169.9
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.