CID 59112312

Schembl14265438

Structural Information

Molecular Formula
C11H12ClF13Si
SMILES
C(C[Si](CCC(F)(F)F)(CCC(F)(F)F)Cl)C(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C11H12ClF13Si/c12-26(5-2-8(15,16)17,6-3-9(18,19)20)4-1-7(13,14)10(21,22)11(23,24)25/h1-6H2
InChIKey
YOCHEZYDHYGFLL-UHFFFAOYSA-N
Compound name
chloro-(3,3,4,4,5,5,5-heptafluoropentyl)-bis(3,3,3-trifluoropropyl)silane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

454.01892 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 455.02620 187.0
[M+Na]+ 477.00814 195.7
[M-H]- 453.01164 172.6
[M+NH4]+ 472.05274 177.3
[M+K]+ 492.98208 189.6
[M+H-H2O]+ 437.01618 173.4
[M+HCOO]- 499.01712 191.7
[M+CH3COO]- 513.03277 226.9
[M+Na-2H]- 474.99359 188.1
[M]+ 454.01837 170.6
[M]- 454.01947 170.6
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