CID 102186

Di(tert-butyl) methyldiperoxysuccinate

Structural Information

Molecular Formula
C13H24O6
SMILES
CC(CC(=O)OOC(C)(C)C)C(=O)OOC(C)(C)C
InChI
InChI=1S/C13H24O6/c1-9(11(15)17-19-13(5,6)7)8-10(14)16-18-12(2,3)4/h9H,8H2,1-7H3
InChIKey
VEOMCUUTIYXSLV-UHFFFAOYSA-N
Compound name
ditert-butyl 2-methylbutanediperoxoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

276.1573 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.164576 162.4
[M+Na]+ 299.146518 167.6
[M-H]- 275.150024 162.5
[M+NH4]+ 294.191123 178.9
[M+K]+ 315.120458 169.9
[M+H-H2O]+ 259.154560 157.9
[M+HCOO]- 321.155501 179.9
[M+CH3COO]- 335.171151 199.0
[M+Na-2H]- 297.131966 164.9
[M]+ 276.15675142 170.7
[M]- 276.15784858 170.7
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