CID 543670

7-oxa-1,3-diazaspiro[4.4]nonane-2,4-dione

Structural Information

Molecular Formula

C₆H₈N₂O₃

SMILES

C1COCC12C(=O)NC(=O)N2

InChI

InChI=1S/C6H8N2O3/c9-4-6(1-2-11-3-6)8-5(10)7-4/h1-3H2,(H2,7,8,9,10)

InChIKey

RRVLAJRWWLRJRR-UHFFFAOYSA-N

Compound name

7-oxa-1,3-diazaspiro[4.4]nonane-2,4-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 156.0535 Da
Monoisotopic Mass: -1.2
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]+	157.06078	130.4
[M+Na]+	179.04272	138.2
[M-H]-	155.04622	131.5
[M+NH4]+	174.08732	151.5
[M+K]+	195.01666	136.9
[M+H-H2O]+	139.05076	125.1
[M+HCOO]-	201.05170	147.6
[M+CH3COO]-	215.06735	165.6
[M+Na-2H]-	177.02817	134.4
[M]+	156.05295	124.8
[M]-	156.05405	124.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe