CID 162345261

2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-tetracosafluorotridec-1-ene

Structural Information

Molecular Formula
C13H2F24
SMILES
C=C(C(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)(F)F)(F)F)(F)F)F
InChI
InChI=1S/C13H2F24/c1-2(14)3(15,16)4(17,18)5(19,20)6(21,22)7(23,24)8(25,26)9(27,28)10(29,30)11(31,32)12(33,34)13(35,36)37/h1H2
InChIKey
KJSXVPLIVYPGRD-UHFFFAOYSA-N
Compound name
2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-tetracosafluorotridec-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

613.97736 Da
Monoisotopic Mass

8.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 614.98464 186.2
[M+Na]+ 636.96658 191.2
[M-H]- 612.97008 196.2
[M+NH4]+ 632.01118 197.9
[M+K]+ 652.94052 203.9
[M+H-H2O]+ 596.97462 174.2
[M+HCOO]- 658.97556 203.7
[M+CH3COO]- 672.99121 254.1
[M+Na-2H]- 634.95203 187.9
[M]+ 613.97681 184.0
[M]- 613.97791 184.0
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.