CID 78793

2,4,8,10-tetraoxaspiro[5.5]undecane, 3,9-di-2-furanyl-

Structural Information

Molecular Formula
C15H16O6
SMILES
C1C2(COC(O1)C3=CC=CO3)COC(OC2)C4=CC=CO4
InChI
InChI=1S/C15H16O6/c1-3-11(16-5-1)13-18-7-15(8-19-13)9-20-14(21-10-15)12-4-2-6-17-12/h1-6,13-14H,7-10H2
InChIKey
RCPOYMZTZWMPSU-UHFFFAOYSA-N
Compound name
3,9-bis(furan-2-yl)-2,4,8,10-tetraoxaspiro[5.5]undecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

3
Patents

292.0947 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.10198 161.0
[M+Na]+ 315.08392 167.7
[M-H]- 291.08742 176.0
[M+NH4]+ 310.12852 173.1
[M+K]+ 331.05786 172.6
[M+H-H2O]+ 275.09196 157.5
[M+HCOO]- 337.09290 177.2
[M+CH3COO]- 351.10855 173.9
[M+Na-2H]- 313.06937 167.2
[M]+ 292.09415 163.7
[M]- 292.09525 163.7
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

patents stripe