CID 24826317

Histamine glutarimide

Structural Information

Molecular Formula

C₁₀H₁₃N₃O₂

SMILES

C1CC(=O)N(C(=O)C1)CCC2=CN=CN2

InChI

InChI=1S/C10H13N3O2/c14-9-2-1-3-10(15)13(9)5-4-8-6-11-7-12-8/h6-7H,1-5H2,(H,11,12)

InChIKey

DYKZYSKWOHKZMF-UHFFFAOYSA-N

Compound name

1-[2-(1H-imidazol-5-yl)ethyl]piperidine-2,6-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 177
Patents: 207.10077 Da
Monoisotopic Mass: -0.4
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]+	208.10805	146.4
[M+Na]+	230.08999	153.4
[M-H]-	206.09349	147.3
[M+NH4]+	225.13459	162.0
[M+K]+	246.06393	149.9
[M+H-H2O]+	190.09803	137.7
[M+HCOO]-	252.09897	163.8
[M+CH3COO]-	266.11462	181.3
[M+Na-2H]-	228.07544	148.8
[M]+	207.10022	142.4
[M]-	207.10132	142.4

Literature stripe

literature stripe

Patent stripe

patents stripe