CID 2774929

1,1,1,2,2,3,3-heptafluoronon-4-ene

Structural Information

Molecular Formula
C9H11F7
SMILES
CCCCC=CC(C(C(F)(F)F)(F)F)(F)F
InChI
InChI=1S/C9H11F7/c1-2-3-4-5-6-7(10,11)8(12,13)9(14,15)16/h5-6H,2-4H2,1H3
InChIKey
DZBBLQUHQSLWOV-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3-heptafluoronon-4-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

252.07489 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.08217 149.4
[M+Na]+ 275.06411 157.5
[M-H]- 251.06761 140.8
[M+NH4]+ 270.10871 166.4
[M+K]+ 291.03805 154.2
[M+H-H2O]+ 235.07215 139.8
[M+HCOO]- 297.07309 160.2
[M+CH3COO]- 311.08874 195.5
[M+Na-2H]- 273.04956 152.9
[M]+ 252.07434 140.0
[M]- 252.07544 140.0
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.