CID 7769

Diisopropyl peroxydicarbonate

Structural Information

Molecular Formula

C₈H₁₄O₆

SMILES

CC(C)OC(=O)OOC(=O)OC(C)C

InChI

InChI=1S/C8H14O6/c1-5(2)11-7(9)13-14-8(10)12-6(3)4/h5-6H,1-4H3

InChIKey

BWJUFXUULUEGMA-UHFFFAOYSA-N

Compound name

propan-2-yl propan-2-yloxycarbonyloxy carbonate

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 46383
Patents: 206.07904 Da
Monoisotopic Mass: 2.6
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]+	207.08632	143.5
[M+Na]+	229.06826	150.6
[M+NH4]+	224.11286	148.1
[M+K]+	245.04220	149.5
[M-H]-	205.07176	139.5
[M+Na-2H]-	227.05371	143.7
[M]+	206.07849	142.8
[M]-	206.07959	142.8

Literature stripe

literature stripe

Patent stripe

patents stripe