CID 12104946

Nonafluorobutyltrifluoroboronanion

Structural Information

Molecular Formula

C₄BF₁₂

SMILES

[B-](C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)(F)F

InChI

InChI=1S/C4BF12/c6-1(7,2(8,9)4(12,13)14)3(10,11)5(15,16)17/q-1

InChIKey

GVHUPPZWFMURCW-UHFFFAOYSA-N

Compound name

trifluoro(1,1,2,2,3,3,4,4,4-nonafluorobutyl)boranuide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 286.99014 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	287.99742	144.5
[M+Na]+	309.97936	154.4
[M-H]-	285.98286	130.1
[M+NH4]+	305.02396	158.7
[M+K]+	325.95330	151.9
[M+H-H2O]+	269.98740	134.5
[M+HCOO]-	331.98834	147.7
[M+CH3COO]-	346.00399	198.6
[M+Na-2H]-	307.96481	148.7
[M]+	286.98959	123.7
[M]-	286.99069	123.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe