CID 164517326

2769970-52-5

Structural Information

Molecular Formula
C14H23BO3
SMILES
B1(OC(C(O1)(CC)CC)(CC)CC)C2=CC=CO2
InChI
InChI=1S/C14H23BO3/c1-5-13(6-2)14(7-3,8-4)18-15(17-13)12-10-9-11-16-12/h9-11H,5-8H2,1-4H3
InChIKey
HAAGDJQTKOSKNP-UHFFFAOYSA-N
Compound name
4,4,5,5-tetraethyl-2-(furan-2-yl)-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.17403 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.18131 153.8
[M+Na]+ 273.16325 161.8
[M-H]- 249.16675 162.5
[M+NH4]+ 268.20785 174.9
[M+K]+ 289.13719 163.1
[M+H-H2O]+ 233.17129 150.8
[M+HCOO]- 295.17223 174.4
[M+CH3COO]- 309.18788 193.4
[M+Na-2H]- 271.14870 159.0
[M]+ 250.17348 159.6
[M]- 250.17458 159.6
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.