CID 21923552

1,1,1,2,2,3,3,4,4,5,5-undecafluorohexane

Structural Information

Molecular Formula
C6H3F11
SMILES
CC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C6H3F11/c1-2(7,8)3(9,10)4(11,12)5(13,14)6(15,16)17/h1H3
InChIKey
PNARBYBREBHBLC-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3,4,4,5,5-undecafluorohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

729
Patents

284.00592 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.01320 148.5
[M+Na]+ 306.99514 158.2
[M-H]- 282.99864 136.5
[M+NH4]+ 302.03974 163.5
[M+K]+ 322.96908 155.8
[M+H-H2O]+ 267.00318 136.8
[M+HCOO]- 329.00412 152.8
[M+CH3COO]- 343.01977 201.8
[M+Na-2H]- 304.98059 152.9
[M]+ 284.00537 131.5
[M]- 284.00647 131.5
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