CID 2774032

1,10-dichloroperfluorodecane

Structural Information

Molecular Formula
C10Cl2F20
SMILES
C(C(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(F)F)(C(C(C(C(F)(F)Cl)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C10Cl2F20/c11-9(29,30)7(25,26)5(21,22)3(17,18)1(13,14)2(15,16)4(19,20)6(23,24)8(27,28)10(12,31)32
InChIKey
URMYIKJKCYYLMX-UHFFFAOYSA-N
Compound name
1,10-dichloro-1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-icosafluorodecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

569.90576 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 570.91304 173.1
[M+Na]+ 592.89498 178.9
[M-H]- 568.89848 182.0
[M+NH4]+ 587.93958 183.9
[M+K]+ 608.86892 190.0
[M+H-H2O]+ 552.90302 162.3
[M+HCOO]- 614.90396 193.9
[M+CH3COO]- 628.91961 245.5
[M+Na-2H]- 590.88043 175.0
[M]+ 569.90521 176.9
[M]- 569.90631 176.9
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.