CID 85264

Dipropyl peroxydicarbonate

Structural Information

Molecular Formula

C₈H₁₄O₆

SMILES

CCCOC(=O)OOC(=O)OCCC

InChI

InChI=1S/C8H14O6/c1-3-5-11-7(9)13-14-8(10)12-6-4-2/h3-6H2,1-2H3

InChIKey

YPVDWEHVCUBACK-UHFFFAOYSA-N

Compound name

propoxycarbonyloxy propyl carbonate

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 18320
Patents: 206.07904 Da
Monoisotopic Mass: 2.8
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	144.0
[M+Na]+	229.06826	151.8
[M+NH4]+	224.11286	148.8
[M+K]+	245.04220	149.0
[M-H]-	205.07176	140.4
[M+Na-2H]-	227.05371	144.8
[M]+	206.07849	143.5
[M]-	206.07959	143.5

Literature stripe

literature stripe

Patent stripe

patents stripe