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

9
Patents

156.04225 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.049526 129.0
[M+Na]+ 179.031468 136.5
[M-H]- 155.034974 132.0
[M+NH4]+ 174.076073 149.4
[M+K]+ 195.005408 137.2
[M+H-H2O]+ 139.039510 123.9
[M+HCOO]- 201.040451 152.5
[M+CH3COO]- 215.056101 170.7
[M+Na-2H]- 177.016916 135.3
[M]+ 156.04170142 131.9
[M]- 156.04279858 131.9
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