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
2
Annotation Hits

0
References

7
Patents

156.04225 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.049526 129.8
[M+Na]+ 179.031468 137.2
[M-H]- 155.034974 132.9
[M+NH4]+ 174.076073 150.3
[M+K]+ 195.005408 138.3
[M+H-H2O]+ 139.039510 124.8
[M+HCOO]- 201.040451 152.4
[M+CH3COO]- 215.056101 171.0
[M+Na-2H]- 177.016916 134.8
[M]+ 156.04170142 132.0
[M]- 156.04279858 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.