CID 9386

Perfluorodecalin

Structural Information

Molecular Formula
C10F18
SMILES
C12(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F
InChI
InChI=1S/C10F18/c11-1-2(12,5(17,18)9(25,26)7(21,22)3(1,13)14)6(19,20)10(27,28)8(23,24)4(1,15)16
InChIKey
UWEYRJFJVCLAGH-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,4a,5,5,6,6,7,7,8,8,8a-octadecafluoronaphthalene
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

768
References

18451
Patents

461.97125 Da
Monoisotopic Mass

5.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 462.97853 160.3
[M+Na]+ 484.96047 160.5
[M+NH4]+ 480.00507 160.5
[M+K]+ 500.93441 160.5
[M-H]- 460.96397 159.6
[M+Na-2H]- 482.94592 161.1
[M]+ 461.97070 160.1
[M]- 461.97180 160.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe