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

6
Patents

192.07864 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.085916 138.4
[M+Na]+ 215.067858 144.0
[M-H]- 191.071364 142.5
[M+NH4]+ 210.112463 150.0
[M+K]+ 231.041798 144.6
[M+H-H2O]+ 175.075900 127.4
[M+HCOO]- 237.076841 157.3
[M+CH3COO]- 251.092491 182.2
[M+Na-2H]- 213.053306 141.6
[M]+ 192.07809142 144.8
[M]- 192.07918858 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