CID 95195

710-94-1

Structural Information

Molecular Formula

C₁₀H₁₆N₂O₂

SMILES

C1CCCC2(CCC1)C(=O)NC(=O)N2

InChI

InChI=1S/C10H16N2O2/c13-8-10(12-9(14)11-8)6-4-2-1-3-5-7-10/h1-7H2,(H2,11,12,13,14)

InChIKey

NMKBJKPVCZJVTI-UHFFFAOYSA-N

Compound name

1,3-diazaspiro[4.7]dodecane-2,4-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 5
References: 51
Patents: 196.12119 Da
Monoisotopic Mass: 1.6
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]+	197.128466	157.9
[M+Na]+	219.110408	162.0
[M-H]-	195.113914	158.0
[M+NH4]+	214.155013	166.4
[M+K]+	235.084348	161.4
[M+H-H2O]+	179.118450	153.7
[M+HCOO]-	241.119391	164.0
[M+CH3COO]-	255.135041	161.6
[M+Na-2H]-	217.095856	156.4
[M]+	196.12064142	153.4
[M]-	196.12173858	153.4

Literature stripe

literature stripe

Patent stripe

patents stripe