CID 16219302

24690-44-6

Structural Information

Molecular Formula
C6H6O6
SMILES
C1[C@@H](OC(=O)O1)[C@@H]2COC(=O)O2
InChI
InChI=1S/C6H6O6/c7-5-9-1-3(11-5)4-2-10-6(8)12-4/h3-4H,1-2H2/t3-,4+
InChIKey
ZWGIZHOZSXFSNW-ZXZARUISSA-N
Compound name
(4S)-4-[(4R)-2-oxo-1,3-dioxolan-4-yl]-1,3-dioxolan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.01643 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.023706 129.1
[M+Na]+ 197.005648 137.0
[M-H]- 173.009154 138.3
[M+NH4]+ 192.050253 147.0
[M+K]+ 212.979588 141.4
[M+H-H2O]+ 157.013690 126.3
[M+HCOO]- 219.014631 149.4
[M+CH3COO]- 233.030281 174.5
[M+Na-2H]- 194.991096 135.2
[M]+ 174.01588142 131.7
[M]- 174.01697858 131.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.