CID 15906195

365564-10-9

Structural Information

Molecular Formula
C14H21BO4
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=C(C=C2)OC)OC
InChI
InChI=1S/C14H21BO4/c1-13(2)14(3,4)19-15(18-13)10-7-8-11(16-5)12(9-10)17-6/h7-9H,1-6H3
InChIKey
QPWUFMRNTUHMJD-UHFFFAOYSA-N
Compound name
2-(3,4-dimethoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

105
Patents

264.1533 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.16058 155.4
[M+Na]+ 287.14252 167.9
[M+NH4]+ 282.18712 165.9
[M+K]+ 303.11646 161.2
[M-H]- 263.14602 160.9
[M+Na-2H]- 285.12797 163.0
[M]+ 264.15275 159.2
[M]- 264.15385 159.2
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