CID 71336351

1,1,1,2,2,3,3,4,4,5,5-undecafluorononadecane

Structural Information

Molecular Formula
C19H29F11
SMILES
CCCCCCCCCCCCCCC(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI
InChI=1S/C19H29F11/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15(20,21)16(22,23)17(24,25)18(26,27)19(28,29)30/h2-14H2,1H3
InChIKey
HIOALUHIGOQIHI-UHFFFAOYSA-N
Compound name
1,1,1,2,2,3,3,4,4,5,5-undecafluorononadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

466.20935 Da
Monoisotopic Mass

11.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 467.21663 208.4
[M+Na]+ 489.19857 193.5
[M-H]- 465.20207 182.8
[M+NH4]+ 484.24317 191.0
[M+K]+ 505.17251 207.6
[M+H-H2O]+ 449.20661 194.3
[M+HCOO]- 511.20755 204.7
[M+CH3COO]- 525.22320 238.0
[M+Na-2H]- 487.18402 206.3
[M]+ 466.20880 186.3
[M]- 466.20990 186.3
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