CID 71310890

143893-70-3

Structural Information

Molecular Formula
CH2B11F11
SMILES
B1(B(B(B([B-]2(B([B-](B2F)(CB(B(B1F)F)F)F)F)F)F)F)F)F
InChI
InChI=1S/CH2B11F11/c13-2-1-11(22)9(20)12(23,10(11)21)8(19)7(18)6(17)5(16)4(15)3(2)14/h1H2/q-2
InChIKey
OCUCLQGZYARIQD-UHFFFAOYSA-N
Compound name
1,2,3,4,5,6,7,8,10,11,12-undecafluoro-2,3,4,5,6,7,8,11,12-nonabora-1,10-diboranuidabicyclo[8.1.1]dodecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.10043 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.10771 182.0
[M+Na]+ 367.08965 191.8
[M-H]- 343.09315 159.0
[M+NH4]+ 362.13425 194.1
[M+K]+ 383.06359 189.8
[M+H-H2O]+ 327.09769 177.5
[M+HCOO]- 389.09863 177.1
[M+CH3COO]- 403.11428 211.4
[M+Na-2H]- 365.07510 179.2
[M]+ 344.09988 172.1
[M]- 344.10098 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

No patent data available for this compound.