CID 16211102

240497-26-1

Structural Information

Molecular Formula
C18H13F27Sn
SMILES
C(C[SnH](CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/3C6H4F9.Sn.H/c3*1-2-3(7,8)4(9,10)5(11,12)6(13,14)15;;/h3*1-2H2;;
InChIKey
IXGCTPQSODDMDJ-UHFFFAOYSA-N
Compound name
tris(3,3,4,4,5,5,6,6,6-nonafluorohexyl)stannane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

861.9608 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 862.96808 230.1
[M+Na]+ 884.95002 233.6
[M-H]- 860.95352 239.1
[M+NH4]+ 879.99462 241.9
[M+K]+ 900.92396 248.9
[M+H-H2O]+ 844.95806 217.0
[M+HCOO]- 906.95900 244.4
[M+CH3COO]- 920.97465 272.3
[M+Na-2H]- 882.93547 228.4
[M]+ 861.96025 225.0
[M]- 861.96135 225.0
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.