CID 148503951

4,4,5,5-tetramethyl-2-(4-methyl-1-benzofuran-7-yl)-1,3,2-dioxaborolane

Structural Information

Molecular Formula
C15H19BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=C3C(=C(C=C2)C)C=CO3
InChI
InChI=1S/C15H19BO3/c1-10-6-7-12(13-11(10)8-9-17-13)16-18-14(2,3)15(4,5)19-16/h6-9H,1-5H3
InChIKey
MLEUWSPIULPEMM-UHFFFAOYSA-N
Compound name
4,4,5,5-tetramethyl-2-(4-methyl-1-benzofuran-7-yl)-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.14273 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.15001 151.3
[M+Na]+ 281.13195 165.4
[M+NH4]+ 276.17655 163.2
[M+K]+ 297.10589 159.9
[M-H]- 257.13545 159.1
[M+Na-2H]- 279.11740 159.0
[M]+ 258.14218 156.2
[M]- 258.14328 156.2
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.