CID 138894

Bromobis(dimethylamino)borane

Structural Information

Molecular Formula

C₄H₁₂BBrN₂

SMILES

B(N(C)C)(N(C)C)Br

InChI

InChI=1S/C4H12BBrN2/c1-7(2)5(6)8(3)4/h1-4H3

InChIKey

UBDPZBLACZIAPS-UHFFFAOYSA-N

Compound name

N-[bromo(dimethylamino)boranyl]-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 50
Patents: 178.0277 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]+	179.034976	131.9
[M+Na]+	201.016918	141.3
[M-H]-	177.020424	137.6
[M+NH4]+	196.061523	156.0
[M+K]+	216.990858	134.0
[M+H-H2O]+	161.024960	130.9
[M+HCOO]-	223.025901	155.2
[M+CH3COO]-	237.041551	191.2
[M+Na-2H]-	199.002366	138.1
[M]+	178.02715142	151.0
[M]-	178.02824858	151.0

Literature stripe

literature stripe

Patent stripe

patents stripe