CID 10931677

33346-67-7

Structural Information

Molecular Formula
C7H8O4
SMILES
COC(=O)[C@@H](C1=CC=CO1)O
InChI
InChI=1S/C7H8O4/c1-10-7(9)6(8)5-3-2-4-11-5/h2-4,6,8H,1H3/t6-/m1/s1
InChIKey
AOCNXXRNLGYQJO-ZCFIWIBFSA-N
Compound name
methyl (2R)-2-(furan-2-yl)-2-hydroxyacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.04225 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.04953 129.8
[M+Na]+ 179.03147 137.2
[M-H]- 155.03497 132.9
[M+NH4]+ 174.07607 150.3
[M+K]+ 195.00541 138.3
[M+H-H2O]+ 139.03951 124.8
[M+HCOO]- 201.04045 152.4
[M+CH3COO]- 215.05610 171.0
[M+Na-2H]- 177.01692 134.8
[M]+ 156.04170 132.0
[M]- 156.04280 132.0
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.