CID 2758200

68716-51-8

Structural Information

Molecular Formula

C₁₂H₁₅BCl₂O₂

SMILES

B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC(=C2)Cl)Cl

InChI

InChI=1S/C12H15BCl2O2/c1-11(2)12(3,4)17-13(16-11)8-5-9(14)7-10(15)6-8/h5-7H,1-4H3

InChIKey

HKSNHZBPIBSVGI-UHFFFAOYSA-N

Compound name

2-(3,5-dichlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 44
Patents: 272.05423 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]+	273.06151	152.3
[M+Na]+	295.04345	167.3
[M+NH4]+	290.08805	164.4
[M+K]+	311.01739	158.5
[M-H]-	271.04695	158.6
[M+Na-2H]-	293.02890	161.2
[M]+	272.05368	157.4
[M]-	272.05478	157.4

Literature stripe

literature stripe

Patent stripe

patents stripe