CID 76169

Dilauryl peroxide

Structural Information

Molecular Formula

C₂₄H₅₀O₂

SMILES

CCCCCCCCCCCCOOCCCCCCCCCCCC

InChI

InChI=1S/C24H50O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3

InChIKey

LGJCFVYMIJLQJO-UHFFFAOYSA-N

Compound name

1-dodecylperoxydodecane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 39223
Patents: 370.38107 Da
Monoisotopic Mass: 11.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	371.388346	206.2
[M+Na]+	393.370288	205.8
[M-H]-	369.373794	202.9
[M+NH4]+	388.414893	218.7
[M+K]+	409.344228	201.8
[M+H-H2O]+	353.378330	198.0
[M+HCOO]-	415.379271	224.4
[M+CH3COO]-	429.394921	225.0
[M+Na-2H]-	391.355736	203.6
[M]+	370.38052142	217.2
[M]-	370.38161858	217.2

Literature stripe

literature stripe

Patent stripe

patents stripe