CID 133672628

3-[(e)-2-(tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]phenol

Structural Information

Molecular Formula
C14H19BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)/C=C/C2=CC(=CC=C2)O
InChI
InChI=1S/C14H19BO3/c1-13(2)14(3,4)18-15(17-13)9-8-11-6-5-7-12(16)10-11/h5-10,16H,1-4H3/b9-8+
InChIKey
ADAOHHDEEUWVKF-CMDGGOBGSA-N
Compound name
3-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.14273 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.15001 153.3
[M+Na]+ 269.13195 165.4
[M+NH4]+ 264.17655 163.8
[M+K]+ 285.10589 158.1
[M-H]- 245.13545 158.5
[M+Na-2H]- 267.11740 160.8
[M]+ 246.14218 156.8
[M]- 246.14328 156.8
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.