CID 28875461

1-(3-methoxyphenyl)cyclopropanecarboxylic acid

Structural Information

Molecular Formula
C11H12O3
SMILES
COC1=CC=CC(=C1)C2(CC2)C(=O)O
InChI
InChI=1S/C11H12O3/c1-14-9-4-2-3-8(7-9)11(5-6-11)10(12)13/h2-4,7H,5-6H2,1H3,(H,12,13)
InChIKey
OKGXVHRWLUXELM-UHFFFAOYSA-N
Compound name
1-(3-methoxyphenyl)cyclopropane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

226
Patents

192.07864 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.08592 144.3
[M+Na]+ 215.06786 157.9
[M+NH4]+ 210.11246 154.3
[M+K]+ 231.04180 152.0
[M-H]- 191.07136 153.7
[M+Na-2H]- 213.05331 155.0
[M]+ 192.07809 150.2
[M]- 192.07919 150.2
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