CID 13815946

2,2-bis(tert-amylperoxy)propane

Structural Information

Molecular Formula
C13H28O4
SMILES
CCC(C)(C)OOC(C)(C)OOC(C)(C)CC
InChI
InChI=1S/C13H28O4/c1-9-11(3,4)14-16-13(7,8)17-15-12(5,6)10-2/h9-10H2,1-8H3
InChIKey
PHIGUQOUWMSXFV-UHFFFAOYSA-N
Compound name
2-methyl-2-[2-(2-methylbutan-2-ylperoxy)propan-2-ylperoxy]butane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1337
Patents

248.19876 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.20604 160.1
[M+Na]+ 271.18798 167.4
[M+NH4]+ 266.23258 165.3
[M+K]+ 287.16192 164.8
[M-H]- 247.19148 156.5
[M+Na-2H]- 269.17343 161.5
[M]+ 248.19821 160.0
[M]- 248.19931 160.0
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