CID 45786032

1346707-96-7

Structural Information

Molecular Formula
C15H22BNO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CC(=NC=C2)OC3CCC3
InChI
InChI=1S/C15H22BNO3/c1-14(2)15(3,4)20-16(19-14)11-8-9-17-13(10-11)18-12-6-5-7-12/h8-10,12H,5-7H2,1-4H3
InChIKey
KYVALDGJBBJJQT-UHFFFAOYSA-N
Compound name
2-cyclobutyloxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.16928 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.17656 158.4
[M+Na]+ 298.15850 166.2
[M+NH4]+ 293.20310 165.0
[M+K]+ 314.13244 161.2
[M-H]- 274.16200 162.1
[M+Na-2H]- 296.14395 164.3
[M]+ 275.16873 159.8
[M]- 275.16983 159.8
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.