CID 103344

1,4,6,10,12,15,16,19-octaoxatrispiro[4.2.2.4.2.2]nonadecane

Structural Information

Molecular Formula
C11H16O8
SMILES
C1COC2(O1)OCC3(CO2)COC4(OCCO4)OC3
InChI
InChI=1S/C11H16O8/c1-2-13-10(12-1)16-5-9(6-17-10)7-18-11(19-8-9)14-3-4-15-11/h1-8H2
InChIKey
RPGPQNVERJRJQD-UHFFFAOYSA-N
Compound name
1,4,6,10,12,15,16,19-octaoxatrispiro[4.2.2.411.28.25]nonadecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

276.0845 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.091776 153.1
[M+Na]+ 299.073718 157.8
[M-H]- 275.077224 165.5
[M+NH4]+ 294.118323 166.6
[M+K]+ 315.047658 166.4
[M+H-H2O]+ 259.081760 152.1
[M+HCOO]- 321.082701 161.4
[M+CH3COO]- 335.098351 164.7
[M+Na-2H]- 297.059166 162.5
[M]+ 276.08395142 153.3
[M]- 276.08504858 153.3
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

patents stripe