CID 102601782

240497-36-3

Structural Information

Molecular Formula
C24H17F27Sn
SMILES
C1=CC=C(C=C1)[Sn](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)CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/3C6H4F9.C6H5.Sn/c3*1-2-3(7,8)4(9,10)5(11,12)6(13,14)15;1-2-4-6-5-3-1;/h3*1-2H2;1-5H;
InChIKey
WFZSJBMGELYANT-UHFFFAOYSA-N
Compound name
tris(3,3,4,4,5,5,6,6,6-nonafluorohexyl)-phenylstannane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

937.9921 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 938.99938 234.6
[M+Na]+ 960.98132 238.7
[M-H]- 936.98482 243.5
[M+NH4]+ 956.02592 246.4
[M+K]+ 976.95526 253.2
[M+H-H2O]+ 920.98936 221.2
[M+HCOO]- 982.99030 253.0
[M+CH3COO]- 997.00595 279.6
[M+Na-2H]- 958.96677 232.8
[M]+ 937.99155 231.1
[M]- 937.99265 231.1
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.