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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.08592 138.4
[M+Na]+ 215.06786 144.0
[M-H]- 191.07136 142.5
[M+NH4]+ 210.11246 150.0
[M+K]+ 231.04180 144.6
[M+H-H2O]+ 175.07590 127.4
[M+HCOO]- 237.07684 157.3
[M+CH3COO]- 251.09249 182.2
[M+Na-2H]- 213.05331 141.6
[M]+ 192.07809 144.8
[M]- 192.07919 144.8
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