CID 59112326

Schembl14265501

Structural Information

Molecular Formula
C13H15F15OSi
SMILES
CO[Si](CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(CCC(F)(F)F)CCC(F)(F)F
InChI
InChI=1S/C13H15F15OSi/c1-29-30(6-3-9(16,17)18,7-4-10(19,20)21)5-2-8(14,15)11(22,23)12(24,25)13(26,27)28/h2-7H2,1H3
InChIKey
OTFMVKGARZMBJF-UHFFFAOYSA-N
Compound name
methoxy-(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-bis(3,3,3-trifluoropropyl)silane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

500.06528 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 501.07256 176.6
[M+Na]+ 523.05450 182.5
[M-H]- 499.05800 179.1
[M+NH4]+ 518.09910 184.1
[M+K]+ 539.02844 189.5
[M+H-H2O]+ 483.06254 167.1
[M+HCOO]- 545.06348 196.4
[M+CH3COO]- 559.07913 236.5
[M+Na-2H]- 521.03995 173.6
[M]+ 500.06473 175.2
[M]- 500.06583 175.2
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

patents stripe