CID 45787287

2642160-40-3

Structural Information

Molecular Formula

C₁₀H₂₀BNO₂

SMILES

B1(OC(C(O1)(C)C)(C)C)C2CCNC2

InChI

InChI=1S/C10H20BNO2/c1-9(2)10(3,4)14-11(13-9)8-5-6-12-7-8/h8,12H,5-7H2,1-4H3

InChIKey

JYEJFUIULVBNAN-UHFFFAOYSA-N

Compound name

3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 197.1587 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]+	198.16598	141.3
[M+Na]+	220.14792	148.3
[M-H]-	196.15142	146.4
[M+NH4]+	215.19252	163.6
[M+K]+	236.12186	148.8
[M+H-H2O]+	180.15596	137.5
[M+HCOO]-	242.15690	158.2
[M+CH3COO]-	256.17255	180.0
[M+Na-2H]-	218.13337	144.8
[M]+	197.15815	139.4
[M]-	197.15925	139.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe