CID 46735167

904326-93-8

Structural Information

Molecular Formula
C9H13BN2O3
SMILES
B(C1=CN=C(C=C1)N2CCOCC2)(O)O
InChI
InChI=1S/C9H13BN2O3/c13-10(14)8-1-2-9(11-7-8)12-3-5-15-6-4-12/h1-2,7,13-14H,3-6H2
InChIKey
FFPQELNXDVTLEW-UHFFFAOYSA-N
Compound name
(6-morpholin-4-ylpyridin-3-yl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

329
Patents

208.10193 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.10921 145.2
[M+Na]+ 231.09115 156.6
[M+NH4]+ 226.13575 152.0
[M+K]+ 247.06509 152.5
[M-H]- 207.09465 147.7
[M+Na-2H]- 229.07660 150.6
[M]+ 208.10138 147.2
[M]- 208.10248 147.2
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