CID 2818110

2-(carboxymethoxy)-3-methoxybenzoic acid

Structural Information

Molecular Formula
C10H10O6
SMILES
COC1=CC=CC(=C1OCC(=O)O)C(=O)O
InChI
InChI=1S/C10H10O6/c1-15-7-4-2-3-6(10(13)14)9(7)16-5-8(11)12/h2-4H,5H2,1H3,(H,11,12)(H,13,14)
InChIKey
LCVDKSGOJCTNKI-UHFFFAOYSA-N
Compound name
2-(carboxymethoxy)-3-methoxybenzoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

226.04774 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.05502 145.8
[M+Na]+ 249.03696 155.7
[M+NH4]+ 244.08156 150.9
[M+K]+ 265.01090 153.2
[M-H]- 225.04046 144.2
[M+Na-2H]- 247.02241 149.0
[M]+ 226.04719 146.3
[M]- 226.04829 146.3
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