CID 105445797

1932038-71-5

Structural Information

Molecular Formula

C₁₁H₁₂O₃

SMILES

C1C(CC1C(=O)O)C2=CC=C(C=C2)O

InChI

InChI=1S/C11H12O3/c12-10-3-1-7(2-4-10)8-5-9(6-8)11(13)14/h1-4,8-9,12H,5-6H2,(H,13,14)

InChIKey

GIDWAQPTNQWOME-UHFFFAOYSA-N

Compound name

3-(4-hydroxyphenyl)cyclobutane-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 192.07864 Da
Monoisotopic Mass: 1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	193.08592	140.9
[M+Na]+	215.06786	148.0
[M+NH4]+	210.11246	144.6
[M+K]+	231.04180	145.0
[M-H]-	191.07136	140.1
[M+Na-2H]-	213.05331	144.2
[M]+	192.07809	140.3
[M]-	192.07919	140.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe