CID 162345261

Ns00102985

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]+ 614.984636 186.2
[M+Na]+ 636.966578 191.2
[M-H]- 612.970084 196.2
[M+NH4]+ 632.011183 197.9
[M+K]+ 652.940518 203.9
[M+H-H2O]+ 596.974620 174.2
[M+HCOO]- 658.975561 203.7
[M+CH3COO]- 672.991211 254.1
[M+Na-2H]- 634.952026 187.9
[M]+ 613.97681142 184.0
[M]- 613.97790858 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.