CID 59112329

Schembl14265502

Structural Information

Molecular Formula
C12H15F13OSi
SMILES
CO[Si](CCC(C(C(F)(F)F)(F)F)(F)F)(CCC(F)(F)F)CCC(F)(F)F
InChI
InChI=1S/C12H15F13OSi/c1-26-27(6-3-9(15,16)17,7-4-10(18,19)20)5-2-8(13,14)11(21,22)12(23,24)25/h2-7H2,1H3
InChIKey
HGBSFYSWOXVUQC-UHFFFAOYSA-N
Compound name
3,3,4,4,5,5,5-heptafluoropentyl-methoxy-bis(3,3,3-trifluoropropyl)silane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

450.06845 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 451.07573 192.8
[M+Na]+ 473.05767 200.3
[M-H]- 449.06117 171.2
[M+NH4]+ 468.10227 176.7
[M+K]+ 489.03161 196.5
[M+H-H2O]+ 433.06571 178.5
[M+HCOO]- 495.06665 190.6
[M+CH3COO]- 509.08230 228.1
[M+Na-2H]- 471.04312 193.7
[M]+ 450.06790 169.4
[M]- 450.06900 169.4
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