CID 168442045

Tert-butyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-carboxylate

Structural Information

Molecular Formula
C15H23BO5
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(O2)C(=O)OC(C)(C)C
InChI
InChI=1S/C15H23BO5/c1-13(2,3)19-12(17)10-8-9-11(18-10)16-20-14(4,5)15(6,7)21-16/h8-9H,1-7H3
InChIKey
QTGPMYOVFVQVFO-UHFFFAOYSA-N
Compound name
tert-butyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)furan-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.16385 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.17113 160.1
[M+Na]+ 317.15307 168.8
[M-H]- 293.15657 169.6
[M+NH4]+ 312.19767 179.8
[M+K]+ 333.12701 171.7
[M+H-H2O]+ 277.16111 158.8
[M+HCOO]- 339.16205 178.5
[M+CH3COO]- 353.17770 201.1
[M+Na-2H]- 315.13852 165.3
[M]+ 294.16330 167.9
[M]- 294.16440 167.9
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.