CID 73797

Dicyclohexyl peroxydicarbonate

Structural Information

Molecular Formula
C14H22O6
SMILES
C1CCC(CC1)OC(=O)OOC(=O)OC2CCCCC2
InChI
InChI=1S/C14H22O6/c15-13(17-11-7-3-1-4-8-11)19-20-14(16)18-12-9-5-2-6-10-12/h11-12H,1-10H2
InChIKey
BLCKNMAZFRMCJJ-UHFFFAOYSA-N
Compound name
cyclohexyl cyclohexyloxycarbonyloxy carbonate
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

9818
Patents

286.14163 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 287.14891 165.5
[M+Na]+ 309.13085 165.8
[M-H]- 285.13435 169.8
[M+NH4]+ 304.17545 179.9
[M+K]+ 325.10479 166.5
[M+H-H2O]+ 269.13889 157.7
[M+HCOO]- 331.13983 180.9
[M+CH3COO]- 345.15548 193.6
[M+Na-2H]- 307.11630 165.6
[M]+ 286.14108 161.7
[M]- 286.14218 161.7
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