CID 261539

10256-01-6

Structural Information

Molecular Formula

C₁₁H₁₈N₂O₄

SMILES

C1COCCN1C(=O)CC(=O)N2CCOCC2

InChI

InChI=1S/C11H18N2O4/c14-10(12-1-5-16-6-2-12)9-11(15)13-3-7-17-8-4-13/h1-9H2

InChIKey

DPNZFWSVHKTMAF-UHFFFAOYSA-N

Compound name

1,3-dimorpholin-4-ylpropane-1,3-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 13
Patents: 242.12666 Da
Monoisotopic Mass: -1.4
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]+	243.13394	156.5
[M+Na]+	265.11588	165.2
[M+NH4]+	260.16048	162.2
[M+K]+	281.08982	162.0
[M-H]-	241.11938	159.5
[M+Na-2H]-	263.10133	158.8
[M]+	242.12611	158.1
[M]-	242.12721	158.1

Literature stripe

literature stripe

Patent stripe

patents stripe