CID 165806544

2803127-27-5

Structural Information

Molecular Formula

C₆H₁₀BF₃N

SMILES

[B-](C(C)(C)CCC#N)(F)(F)F

InChI

InChI=1S/C6H10BF3N/c1-6(2,4-3-5-11)7(8,9)10/h3-4H2,1-2H3/q-1

InChIKey

YVDZXNUINIRRHM-UHFFFAOYSA-N

Compound name

(4-cyano-2-methylbutan-2-yl)-trifluoroboranuide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 164.08585 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]+	165.09313	137.5
[M+Na]+	187.07507	145.0
[M+NH4]+	182.11967	139.5
[M+K]+	203.04901	138.1
[M-H]-	163.07857	125.2
[M+Na-2H]-	185.06052	136.7
[M]+	164.08530	133.9
[M]-	164.08640	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.