CID 67439

Tricyclohexylidene peroxide

Structural Information

Molecular Formula
C18H30O6
SMILES
C1CCC2(CC1)OOC3(CCCCC3)OOC4(CCCCC4)OO2
InChI
InChI=1S/C18H30O6/c1-4-10-16(11-5-1)19-21-17(12-6-2-7-13-17)23-24-18(22-20-16)14-8-3-9-15-18/h1-15H2
InChIKey
JRYHDZOSVUAAJC-UHFFFAOYSA-N
Compound name
7,8,15,16,23,24-hexaoxatrispiro[5.2.59.2.517.26]tetracosane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

8
Patents

342.20422 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.21150 196.6
[M+Na]+ 365.19344 197.7
[M+NH4]+ 360.23804 198.0
[M+K]+ 381.16738 194.9
[M-H]- 341.19694 198.2
[M+Na-2H]- 363.17889 195.5
[M]+ 342.20367 197.3
[M]- 342.20477 197.3
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