CID 11367616

331958-88-4

Structural Information

Molecular Formula

C₁₀H₁₉BO₃

SMILES

B1(OC(C(O1)(C)C)(C)C)C2CCCO2

InChI

InChI=1S/C10H19BO3/c1-9(2)10(3,4)14-11(13-9)8-6-5-7-12-8/h8H,5-7H2,1-4H3

InChIKey

NRIHVWDOPTVSAN-UHFFFAOYSA-N

Compound name

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

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 198.14273 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]+	199.150006	138.9
[M+Na]+	221.131948	146.4
[M-H]-	197.135454	147.4
[M+NH4]+	216.176553	161.8
[M+K]+	237.105888	149.0
[M+H-H2O]+	181.139990	136.7
[M+HCOO]-	243.140931	157.8
[M+CH3COO]-	257.156581	182.4
[M+Na-2H]-	219.117396	144.4
[M]+	198.14218142	140.4
[M]-	198.14327858	140.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe