CID 19780784

(e)-1,1,1,2,2,5,5,6,6,6-decafluoro-3-hexene

Structural Information

Molecular Formula
C6H2F10
SMILES
C(=C/C(C(F)(F)F)(F)F)\C(C(F)(F)F)(F)F
InChI
InChI=1S/C6H2F10/c7-3(8,5(11,12)13)1-2-4(9,10)6(14,15)16/h1-2H/b2-1+
InChIKey
LGOQFJQJNHYWHK-OWOJBTEDSA-N
Compound name
(E)-1,1,1,2,2,5,5,6,6,6-decafluorohex-3-ene
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

224
Patents

263.9997 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.00698 144.4
[M+Na]+ 286.98892 154.2
[M-H]- 262.99242 133.1
[M+NH4]+ 282.03352 160.4
[M+K]+ 302.96286 151.0
[M+H-H2O]+ 246.99696 133.1
[M+HCOO]- 308.99790 151.4
[M+CH3COO]- 323.01355 195.7
[M+Na-2H]- 284.97437 148.4
[M]+ 263.99915 128.7
[M]- 264.00025 128.7
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

patents stripe