CID 31216

Tributylborane

Structural Information

Molecular Formula

C₁₂H₂₇B

SMILES

B(CCCC)(CCCC)CCCC

InChI

InChI=1S/C12H27B/c1-4-7-10-13(11-8-5-2)12-9-6-3/h4-12H2,1-3H3

InChIKey

CMHHITPYCHHOGT-UHFFFAOYSA-N

Compound name

tributylborane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 125
References: 8995
Patents: 182.22058 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]+	183.22786	148.1
[M+Na]+	205.20980	158.0
[M+NH4]+	200.25440	156.3
[M+K]+	221.18374	150.3
[M-H]-	181.21330	148.4
[M+Na-2H]-	203.19525	151.2
[M]+	182.22003	149.5
[M]-	182.22113	149.5

Literature stripe

literature stripe

Patent stripe

patents stripe