CID 10856393

2-((4-methoxybenzyl)oxy)acetic acid

Structural Information

Molecular Formula
C10H12O4
SMILES
COC1=CC=C(C=C1)COCC(=O)O
InChI
InChI=1S/C10H12O4/c1-13-9-4-2-8(3-5-9)6-14-7-10(11)12/h2-5H,6-7H2,1H3,(H,11,12)
InChIKey
XNXTXCKLOBWPQA-UHFFFAOYSA-N
Compound name
2-[(4-methoxyphenyl)methoxy]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

220
Patents

196.07356 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.08084 140.8
[M+Na]+ 219.06278 152.2
[M+NH4]+ 214.10738 147.8
[M+K]+ 235.03672 147.2
[M-H]- 195.06628 141.2
[M+Na-2H]- 217.04823 146.2
[M]+ 196.07301 142.3
[M]- 196.07411 142.3
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