CID 98453530

Dtxsid50895403

Structural Information

Molecular Formula
C10H2ClF17
SMILES
C=C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cl
InChI
InChI=1S/C10H2ClF17/c1-2(11)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)10(26,27)28/h1H2
InChIKey
TXEZRHDYRLWBDY-UHFFFAOYSA-N
Compound name
2-chloro-3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,10-heptadecafluorodec-1-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

479.95737 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 480.96465 185.5
[M+Na]+ 502.94659 172.7
[M-H]- 478.95009 172.5
[M+NH4]+ 497.99119 175.4
[M+K]+ 518.92053 190.0
[M+H-H2O]+ 462.95463 170.8
[M+HCOO]- 524.95557 184.9
[M+CH3COO]- 538.97122 233.8
[M+Na-2H]- 500.93204 187.1
[M]+ 479.95682 166.5
[M]- 479.95792 166.5
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.