CID 53471075

71888-66-9

Structural Information

Molecular Formula
C9H16O6
SMILES
C1C(OC(O1)CC2OCC(O2)CO)CO
InChI
InChI=1S/C9H16O6/c10-2-6-4-12-8(14-6)1-9-13-5-7(3-11)15-9/h6-11H,1-5H2
InChIKey
GDDKXLIRBQFWTN-UHFFFAOYSA-N
Compound name
[2-[[4-(hydroxymethyl)-1,3-dioxolan-2-yl]methyl]-1,3-dioxolan-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.09468 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.101956 147.1
[M+Na]+ 243.083898 152.1
[M-H]- 219.087404 153.0
[M+NH4]+ 238.128503 161.9
[M+K]+ 259.057838 155.2
[M+H-H2O]+ 203.091940 143.7
[M+HCOO]- 265.092881 163.0
[M+CH3COO]- 279.108531 180.1
[M+Na-2H]- 241.069346 150.7
[M]+ 220.09413142 148.5
[M]- 220.09522858 148.5
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.