CID 44119824

874219-17-7

Structural Information

Molecular Formula
C11H14BNO4
SMILES
B(C1=CC=CC=C1C(=O)N2CCOCC2)(O)O
InChI
InChI=1S/C11H14BNO4/c14-11(13-5-7-17-8-6-13)9-3-1-2-4-10(9)12(15)16/h1-4,15-16H,5-8H2
InChIKey
DUXSLRIREWOQJJ-UHFFFAOYSA-N
Compound name
[2-(morpholine-4-carbonyl)phenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

235.1016 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.10888 151.5
[M+Na]+ 258.09082 162.0
[M+NH4]+ 253.13542 157.9
[M+K]+ 274.06476 158.5
[M-H]- 234.09432 153.9
[M+Na-2H]- 256.07627 156.1
[M]+ 235.10105 153.3
[M]- 235.10215 153.3
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