CID 54594010

[4-(oxolan-3-yloxy)phenyl]boronic acid

Structural Information

Molecular Formula
C10H13BO4
SMILES
B(C1=CC=C(C=C1)OC2CCOC2)(O)O
InChI
InChI=1S/C10H13BO4/c12-11(13)8-1-3-9(4-2-8)15-10-5-6-14-7-10/h1-4,10,12-13H,5-7H2
InChIKey
UFIRHIKFYGAQSK-UHFFFAOYSA-N
Compound name
[4-(oxolan-3-yloxy)phenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

208.09068 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.09796 143.8
[M+Na]+ 231.07990 153.9
[M+NH4]+ 226.12450 151.3
[M+K]+ 247.05384 151.7
[M-H]- 207.08340 146.7
[M+Na-2H]- 229.06535 148.5
[M]+ 208.09013 145.8
[M]- 208.09123 145.8
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

patents stripe