CID 127264418

1799614-84-8

Structural Information

Molecular Formula

C₁₀H₁₄BFO₃

SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC=C(O2)F

InChI

InChI=1S/C10H14BFO3/c1-9(2)10(3,4)15-11(14-9)7-5-6-8(12)13-7/h5-6H,1-4H3

InChIKey

NPJTUPAPNWAHMR-UHFFFAOYSA-N

Compound name

2-(5-fluorofuran-2-yl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 47
Patents: 212.102 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]+	213.10928	136.9
[M+Na]+	235.09122	147.5
[M-H]-	211.09472	145.3
[M+NH4]+	230.13582	159.7
[M+K]+	251.06516	149.4
[M+H-H2O]+	195.09926	134.1
[M+HCOO]-	257.10020	157.8
[M+CH3COO]-	271.11585	185.4
[M+Na-2H]-	233.07667	143.2
[M]+	212.10145	140.6
[M]-	212.10255	140.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe