CID 138401410

6867-36-3

Structural Information

Molecular Formula
C22H10BF15O
SMILES
[B-](C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)(C3=C(C(=C(C(=C3F)F)F)F)F)[O+](CC)CC
InChI
InChI=1S/C22H10BF15O/c1-3-39(4-2)23(5-8(24)14(30)20(36)15(31)9(5)25,6-10(26)16(32)21(37)17(33)11(6)27)7-12(28)18(34)22(38)19(35)13(7)29/h3-4H2,1-2H3
InChIKey
VLTDIZAEUVUPMF-UHFFFAOYSA-N
Compound name
diethyloxonio-tris(2,3,4,5,6-pentafluorophenyl)boranuide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

586.05853 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 587.06581 167.5
[M+Na]+ 609.04775 168.2
[M+NH4]+ 604.09235 167.2
[M+K]+ 625.02169 167.9
[M-H]- 585.05125 165.6
[M+Na-2H]- 607.03320 167.5
[M]+ 586.05798 167.0
[M]- 586.05908 167.0
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.