CID 59112344

Schembl14265497

Structural Information

Molecular Formula
C13H17F13OSi
SMILES
CC[Si](CC)(CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)OC
InChI
InChI=1S/C13H17F13OSi/c1-4-28(5-2,27-3)7-6-8(14,15)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h4-7H2,1-3H3
InChIKey
JXQMTUPDEQOCOA-UHFFFAOYSA-N
Compound name
diethyl-methoxy-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)silane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

464.0841 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 465.09138 174.3
[M+Na]+ 487.07332 180.4
[M-H]- 463.07682 176.9
[M+NH4]+ 482.11792 181.8
[M+K]+ 503.04726 186.9
[M+H-H2O]+ 447.08136 181.7
[M+HCOO]- 509.08230 194.6
[M+CH3COO]- 523.09795 232.6
[M+Na-2H]- 485.05877 197.5
[M]+ 464.08355 174.9
[M]- 464.08465 174.9
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

patents stripe