CID 25795

Glycerol triglycidyl ether

Structural Information

Molecular Formula

C₁₂H₂₀O₆

SMILES

C1C(O1)COCC(COCC2CO2)OCC3CO3

InChI

InChI=1S/C12H20O6/c1(13-3-10-5-16-10)9(15-7-12-8-18-12)2-14-4-11-6-17-11/h9-12H,1-8H2

InChIKey

SYEWHONLFGZGLK-UHFFFAOYSA-N

Compound name

2-[1,3-bis(oxiran-2-ylmethoxy)propan-2-yloxymethyl]oxirane

Related CIDs

2D Structure

compound 2d structure

6
Annotation Hits: 1
References: 26505
Patents: 260.12598 Da
Monoisotopic Mass: -1.1
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]+	261.13326	176.1
[M+Na]+	283.11520	178.5
[M-H]-	259.11870	184.7
[M+NH4]+	278.15980	173.4
[M+K]+	299.08914	182.7
[M+H-H2O]+	243.12324	169.4
[M+HCOO]-	305.12418	187.6
[M+CH3COO]-	319.13983	215.3
[M+Na-2H]-	281.10065	176.7
[M]+	260.12543	186.1
[M]-	260.12653	186.1

Literature stripe

literature stripe

Patent stripe

patents stripe