CID 23005412

[4-(cyclopentyloxy)phenyl]boronic acid

Structural Information

Molecular Formula
C11H15BO3
SMILES
B(C1=CC=C(C=C1)OC2CCCC2)(O)O
InChI
InChI=1S/C11H15BO3/c13-12(14)9-5-7-11(8-6-9)15-10-3-1-2-4-10/h5-8,10,13-14H,1-4H2
InChIKey
AAMPOFTVRYFQCX-UHFFFAOYSA-N
Compound name
(4-cyclopentyloxyphenyl)boronic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

206.11142 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.11870 144.6
[M+Na]+ 229.10064 149.6
[M-H]- 205.10414 148.2
[M+NH4]+ 224.14524 163.5
[M+K]+ 245.07458 147.1
[M+H-H2O]+ 189.10868 138.6
[M+HCOO]- 251.10962 164.2
[M+CH3COO]- 265.12527 179.0
[M+Na-2H]- 227.08609 146.6
[M]+ 206.11087 141.1
[M]- 206.11197 141.1
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