CID 24208797

947191-69-7

Structural Information

Molecular Formula
C15H22BNO3
SMILES
B1(OC(C(O1)(C)C)(C)C)C2=CN=C(C=C2)OCC3CC3
InChI
InChI=1S/C15H22BNO3/c1-14(2)15(3,4)20-16(19-14)12-7-8-13(17-9-12)18-10-11-5-6-11/h7-9,11H,5-6,10H2,1-4H3
InChIKey
QEQNYJUPYICBCR-UHFFFAOYSA-N
Compound name
2-(cyclopropylmethoxy)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

275.16928 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.17656 164.2
[M+Na]+ 298.15850 178.4
[M+NH4]+ 293.20310 175.4
[M+K]+ 314.13244 172.2
[M-H]- 274.16200 177.9
[M+Na-2H]- 296.14395 175.1
[M]+ 275.16873 171.7
[M]- 275.16983 171.7
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

patents stripe