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

0
Patents

347.982 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.98928 158.4
[M+Na]+ 370.97122 167.2
[M-H]- 346.97472 143.9
[M+NH4]+ 366.01582 170.3
[M+K]+ 386.94516 164.4
[M+H-H2O]+ 330.97926 144.6
[M+HCOO]- 392.98020 159.6
[M+CH3COO]- 406.99585 212.7
[M+Na-2H]- 368.95667 157.2
[M]+ 347.98145 138.5
[M]- 347.98255 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