CID 23432499

1-ethoxy-1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane

Structural Information

Molecular Formula
C7H5F11O
SMILES
CCOC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C7H5F11O/c1-2-19-7(17,18)5(12,13)3(8,9)4(10,11)6(14,15)16/h2H2,1H3
InChIKey
YCXOPGWIXHEAFZ-UHFFFAOYSA-N
Compound name
1-ethoxy-1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

97
Patents

314.01648 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.02376 156.5
[M+Na]+ 337.00570 165.8
[M-H]- 313.00920 144.3
[M+NH4]+ 332.05030 170.3
[M+K]+ 352.97964 163.6
[M+H-H2O]+ 297.01374 144.5
[M+HCOO]- 359.01468 160.7
[M+CH3COO]- 373.03033 206.4
[M+Na-2H]- 334.99115 160.6
[M]+ 314.01593 141.2
[M]- 314.01703 141.2
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.