CID 89438352

Dtxsid40895457

Structural Information

Molecular Formula
C11F22
SMILES
C(=C(F)F)(C(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F
InChI
InChI=1S/C11F22/c12-1(2(13)14)3(15,16)4(17,18)5(19,20)6(21,22)7(23,24)8(25,26)9(27,28)10(29,30)11(31,32)33
InChIKey
DVQLQARMQAHYFI-UHFFFAOYSA-N
Compound name
1,1,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-docosafluoroundec-1-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

64
Patents

549.96484 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 550.97212 175.6
[M+Na]+ 572.95406 182.0
[M-H]- 548.95756 184.3
[M+NH4]+ 567.99866 186.9
[M+K]+ 588.92800 192.5
[M+H-H2O]+ 532.96210 165.8
[M+HCOO]- 594.96304 191.8
[M+CH3COO]- 608.97869 245.4
[M+Na-2H]- 570.93951 177.2
[M]+ 549.96429 172.1
[M]- 549.96539 172.1
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