CID 71306529

446311-34-8

Structural Information

Molecular Formula
C19H23BO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)C3=CC=C(C=C3)OC
InChI
InChI=1S/C19H23BO3/c1-18(2)19(3,4)23-20(22-18)16-10-6-14(7-11-16)15-8-12-17(21-5)13-9-15/h6-13H,1-5H3
InChIKey
XIWRWTPGYBTKPL-UHFFFAOYSA-N
Compound name
2-[4-(4-methoxyphenyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

310.174 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 311.18128 169.5
[M+Na]+ 333.16322 178.8
[M-H]- 309.16672 181.5
[M+NH4]+ 328.20782 187.9
[M+K]+ 349.13716 177.9
[M+H-H2O]+ 293.17126 163.1
[M+HCOO]- 355.17220 190.2
[M+CH3COO]- 369.18785 205.9
[M+Na-2H]- 331.14867 173.7
[M]+ 310.17345 174.0
[M]- 310.17455 174.0
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