CID 138991162

2309433-01-8

Structural Information

Molecular Formula
C6H8O4
SMILES
C1[C@@H]2[C@H](CC1O)OC(=O)O2
InChI
InChI=1S/C6H8O4/c7-3-1-4-5(2-3)10-6(8)9-4/h3-5,7H,1-2H2/t3?,4-,5+
InChIKey
VTRNOYGGTWUTGH-NVGWPGHNSA-N
Compound name
(3aS,6aR)-5-hydroxy-4,5,6,6a-tetrahydro-3aH-cyclopenta[d][1,3]dioxol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

144.04225 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.04953 125.1
[M+Na]+ 167.03147 134.0
[M+NH4]+ 162.07607 133.2
[M+K]+ 183.00541 134.7
[M-H]- 143.03497 127.3
[M+Na-2H]- 165.01692 125.8
[M]+ 144.04170 126.6
[M]- 144.04280 126.6
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.