CID 24705775

Potassium 2-(furan-2-ylmethoxy)acetate

Structural Information

Molecular Formula

C₇H₈O₄

SMILES

C1=COC(=C1)COCC(=O)O

InChI

InChI=1S/C7H8O4/c8-7(9)5-10-4-6-2-1-3-11-6/h1-3H,4-5H2,(H,8,9)

InChIKey

PDLBGOHATIRQBG-UHFFFAOYSA-N

Compound name

2-(furan-2-ylmethoxy)acetic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 156.04225 Da
Monoisotopic Mass: 0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	157.04953	130.0
[M+Na]+	179.03147	139.9
[M+NH4]+	174.07607	137.0
[M+K]+	195.00541	138.0
[M-H]-	155.03497	130.7
[M+Na-2H]-	177.01692	133.9
[M]+	156.04170	131.2
[M]-	156.04280	131.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe