CID 9855568

(4-(1-hydroxyethyl)phenyl)boronic acid

Structural Information

Molecular Formula
C8H11BO3
SMILES
B(C1=CC=C(C=C1)C(C)O)(O)O
InChI
InChI=1S/C8H11BO3/c1-6(10)7-2-4-8(5-3-7)9(11)12/h2-6,10-12H,1H3
InChIKey
QORATNLZEOZUPG-UHFFFAOYSA-N
Compound name
[4-(1-hydroxyethyl)phenyl]boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

166.08012 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.08740 133.8
[M+Na]+ 189.06934 144.5
[M+NH4]+ 184.11394 141.1
[M+K]+ 205.04328 140.8
[M-H]- 165.07284 133.8
[M+Na-2H]- 187.05479 138.5
[M]+ 166.07957 135.1
[M]- 166.08067 135.1
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