CID 3301663

Tert-butylboronic acid pinacol ester

Structural Information

Molecular Formula
C10H21BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C(C)(C)C
InChI
InChI=1S/C10H21BO2/c1-8(2,3)11-12-9(4,5)10(6,7)13-11/h1-7H3
InChIKey
ZQEPUUOQJIWIFJ-UHFFFAOYSA-N
Compound name
2-tert-butyl-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

362
Patents

184.16347 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.17075 135.0
[M+Na]+ 207.15269 143.9
[M-H]- 183.15619 140.5
[M+NH4]+ 202.19729 159.1
[M+K]+ 223.12663 146.0
[M+H-H2O]+ 167.16073 133.4
[M+HCOO]- 229.16167 154.0
[M+CH3COO]- 243.17732 183.1
[M+Na-2H]- 205.13814 143.1
[M]+ 184.16292 138.6
[M]- 184.16402 138.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.