CID 16717267

Tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)stannanylium

Structural Information

Molecular Formula
C24H12F39Sn
SMILES
C(C[Sn+](CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/3C8H4F13.Sn/c3*1-2-3(9,10)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21;/h3*1-2H2;/q;;;+1
InChIKey
UBIAKEKUQJCWFL-UHFFFAOYSA-N
Compound name
tris(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)stannanylium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

1160.9338 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 1161.9411 282.8
[M+Na]+ 1183.9230 283.5
[M-H]- 1159.9265 294.9
[M+NH4]+ 1178.9676 293.6
[M+K]+ 1199.8970 298.4
[M+H-H2O]+ 1143.9311 269.1
[M+HCOO]- 1205.9320 293.9
[M+CH3COO]- 1219.9477 278.9
[M+Na-2H]- 1181.9085 282.6
[M]+ 1160.9333 274.4
[M]- 1160.9343 274.4
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

No patent data available for this compound.