CID 3086842

Brn 5351487

Structural Information

Molecular Formula
C11H15F7INO3Si
SMILES
C1CO[Si]2(OCCN1CCO2)C(CC(C(C(F)(F)F)(F)F)(F)F)I
InChI
InChI=1S/C11H15F7INO3Si/c12-9(13,10(14,15)11(16,17)18)7-8(19)24-21-4-1-20(2-5-22-24)3-6-23-24/h8H,1-7H2
InChIKey
OQTYDEFANMOWFR-UHFFFAOYSA-N
Compound name
1-(3,3,4,4,5,5,5-heptafluoro-1-iodopentyl)-2,8,9-trioxa-5-aza-1-silabicyclo[3.3.3]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

496.9754 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 497.98268 169.9
[M+Na]+ 519.96462 169.9
[M+NH4]+ 515.00922 169.9
[M+K]+ 535.93856 169.9
[M-H]- 495.96812 169.9
[M+Na-2H]- 517.95007 169.9
[M]+ 496.97485 169.9
[M]- 496.97595 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.