CID 22002932

1,1,1,2,2,3,3,4,4-nonafluorononane

Structural Information

Molecular Formula
C9H11F9
SMILES
CCCCCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C9H11F9/c1-2-3-4-5-6(10,11)7(12,13)8(14,15)9(16,17)18/h2-5H2,1H3
InChIKey
GYDMBTYTWYNRGO-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3,4,4-nonafluorononane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

15
References

339
Patents

290.07172 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.07900 156.6
[M+Na]+ 313.06094 164.7
[M-H]- 289.06444 145.9
[M+NH4]+ 308.10554 171.7
[M+K]+ 329.03488 161.8
[M+H-H2O]+ 273.06898 145.5
[M+HCOO]- 335.06992 163.5
[M+CH3COO]- 349.08557 203.7
[M+Na-2H]- 311.04639 159.7
[M]+ 290.07117 144.3
[M]- 290.07227 144.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe