CID 57764587

933986-82-4

Structural Information

Molecular Formula
C14H19BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)/C=C/C2=CC=C(C=C2)O
InChI
InChI=1S/C14H19BO3/c1-13(2)14(3,4)18-15(17-13)10-9-11-5-7-12(16)8-6-11/h5-10,16H,1-4H3/b10-9+
InChIKey
DMDJHWXECJJTCD-MDZDMXLPSA-N
Compound name
4-[(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

3
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

literature stripe

Patent stripe

patents stripe