CID 13319070

62949-64-8

Structural Information

Molecular Formula
C7H3F11O
SMILES
CO/C(=C(/C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)\F)/F
InChI
InChI=1S/C7H3F11O/c1-19-3(9)2(8)4(10,11)5(12,13)6(14,15)7(16,17)18/h1H3/b3-2-
InChIKey
AXAYXKXNUQHQFZ-IHWYPQMZSA-N
Compound name
(E)-1,2,3,3,4,4,5,5,6,6,6-undecafluoro-1-methoxyhex-1-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

312.00082 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.00810 152.9
[M+Na]+ 334.99004 161.9
[M-H]- 310.99354 140.5
[M+NH4]+ 330.03464 166.7
[M+K]+ 350.96398 159.5
[M+H-H2O]+ 294.99808 140.7
[M+HCOO]- 356.99902 157.0
[M+CH3COO]- 371.01467 205.5
[M+Na-2H]- 332.97549 154.0
[M]+ 312.00027 136.4
[M]- 312.00137 136.4
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.