CID 99770881

757-72-2

Structural Information

Molecular Formula
C12H6ClF21O3Si
SMILES
C(C(C(C(F)(F)F)(F)F)(F)F)O[Si](OCC(C(C(F)(F)F)(F)F)(F)F)(OCC(C(C(F)(F)F)(F)F)(F)F)Cl
InChI
InChI=1S/C12H6ClF21O3Si/c13-38(35-1-4(14,15)7(20,21)10(26,27)28,36-2-5(16,17)8(22,23)11(29,30)31)37-3-6(18,19)9(24,25)12(32,33)34/h1-3H2
InChIKey
XARNYZYNECWSDC-UHFFFAOYSA-N
Compound name
chloro-tris(2,2,3,3,4,4,4-heptafluorobutoxy)silane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

659.944 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 660.95128 184.8
[M+Na]+ 682.93322 188.9
[M-H]- 658.93672 194.1
[M+NH4]+ 677.97782 196.9
[M+K]+ 698.90716 200.6
[M+H-H2O]+ 642.94126 173.4
[M+HCOO]- 704.94220 204.5
[M+CH3COO]- 718.95785 254.3
[M+Na-2H]- 680.91867 184.5
[M]+ 659.94345 185.5
[M]- 659.94455 185.5
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.