CID 6365727

73928-40-2

Structural Information

Molecular Formula
C7HF13O
SMILES
C(C(C(C(C(OC(=C(F)F)F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7HF13O/c8-1(9)2(10)21-7(19,20)6(17,18)5(15,16)4(13,14)3(11)12/h3H
InChIKey
IBBCNYCWBLECNN-UHFFFAOYSA-N
Compound name
1,1,2,2,3,3,4,4,5,5-decafluoro-1-(1,2,2-trifluoroethenoxy)pentane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1
Patents

347.982 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.989276 158.4
[M+Na]+ 370.971218 167.2
[M-H]- 346.974724 143.9
[M+NH4]+ 366.015823 170.3
[M+K]+ 386.945158 164.4
[M+H-H2O]+ 330.979260 144.6
[M+HCOO]- 392.980201 159.6
[M+CH3COO]- 406.995851 212.7
[M+Na-2H]- 368.956666 157.2
[M]+ 347.98145142 138.5
[M]- 347.98254858 138.5
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

patents stripe