CID 74649

2-(4-methoxyphenoxy)acetic acid

Structural Information

Molecular Formula
C9H10O4
SMILES
COC1=CC=C(C=C1)OCC(=O)O
InChI
InChI=1S/C9H10O4/c1-12-7-2-4-8(5-3-7)13-6-9(10)11/h2-5H,6H2,1H3,(H,10,11)
InChIKey
BHFSBJHPPFJCOS-UHFFFAOYSA-N
Compound name
2-(4-methoxyphenoxy)acetic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

6
References

589
Patents

182.0579 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.06518 136.3
[M+Na]+ 205.04712 147.9
[M+NH4]+ 200.09172 143.5
[M+K]+ 221.02106 143.2
[M-H]- 181.05062 136.7
[M+Na-2H]- 203.03257 141.9
[M]+ 182.05735 137.8
[M]- 182.05845 137.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe