CID 2436052

5-(4-methoxyphenoxymethyl)-2-methylfuran-3-carboxylic acid

Structural Information

Molecular Formula
C14H14O5
SMILES
CC1=C(C=C(O1)COC2=CC=C(C=C2)OC)C(=O)O
InChI
InChI=1S/C14H14O5/c1-9-13(14(15)16)7-12(19-9)8-18-11-5-3-10(17-2)4-6-11/h3-7H,8H2,1-2H3,(H,15,16)
InChIKey
DEAUUAZEQGZVQZ-UHFFFAOYSA-N
Compound name
5-[(4-methoxyphenoxy)methyl]-2-methylfuran-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

262.08414 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.09142 156.9
[M+Na]+ 285.07336 169.1
[M+NH4]+ 280.11796 163.5
[M+K]+ 301.04730 166.3
[M-H]- 261.07686 160.0
[M+Na-2H]- 283.05881 162.2
[M]+ 262.08359 159.4
[M]- 262.08469 159.4
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

No patent data available for this compound.