CID 23629516

870004-04-9

Structural Information

Molecular Formula
C14H19BO2
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C=C
InChI
InChI=1S/C14H19BO2/c1-6-11-7-9-12(10-8-11)15-16-13(2,3)14(4,5)17-15/h6-10H,1H2,2-5H3
InChIKey
ONBKTEDYJFZZCU-UHFFFAOYSA-N
Compound name
2-(4-ethenylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

56
Patents

230.14781 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.15509 149.4
[M+Na]+ 253.13703 162.6
[M+NH4]+ 248.18163 160.8
[M+K]+ 269.11097 154.4
[M-H]- 229.14053 155.7
[M+Na-2H]- 251.12248 158.0
[M]+ 230.14726 153.5
[M]- 230.14836 153.5
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