CID 120203

Perfluorodecane

Structural Information

Molecular Formula
C10F22
SMILES
C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10F22/c11-1(12,3(15,16)5(19,20)7(23,24)9(27,28)29)2(13,14)4(17,18)6(21,22)8(25,26)10(30,31)32
InChIKey
BPHQIXJDBIHMLT-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-docosafluorodecane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

2
References

5355
Patents

537.96484 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 538.97212 169.3
[M+Na]+ 560.95406 174.5
[M-H]- 536.95756 177.1
[M+NH4]+ 555.99866 179.1
[M+K]+ 576.92800 185.1
[M+H-H2O]+ 520.96210 157.8
[M+HCOO]- 582.96304 189.5
[M+CH3COO]- 596.97869 243.6
[M+Na-2H]- 558.93951 171.0
[M]+ 537.96429 167.6
[M]- 537.96539 167.6
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.