CID 96220124

1903428-52-3

Structural Information

Molecular Formula
C6H10O4
SMILES
C1[C@H]([C@@H](CO1)O)CC(=O)O
InChI
InChI=1S/C6H10O4/c7-5-3-10-2-4(5)1-6(8)9/h4-5,7H,1-3H2,(H,8,9)/t4-,5-/m1/s1
InChIKey
GBZYAZAPURJGQP-RFZPGFLSSA-N
Compound name
2-[(3R,4S)-4-hydroxyoxolan-3-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.0579 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.06518 128.3
[M+Na]+ 169.04712 134.7
[M-H]- 145.05062 129.7
[M+NH4]+ 164.09172 148.6
[M+K]+ 185.02106 135.1
[M+H-H2O]+ 129.05516 123.9
[M+HCOO]- 191.05610 147.7
[M+CH3COO]- 205.07175 167.1
[M+Na-2H]- 167.03257 132.1
[M]+ 146.05735 126.5
[M]- 146.05845 126.5
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.