CID 119329

Alaptide

Structural Information

Molecular Formula

C₉H₁₄N₂O₂

SMILES

C[C@H]1C(=O)NC2(CCCC2)C(=O)N1

InChI

InChI=1S/C9H14N2O2/c1-6-7(12)11-9(8(13)10-6)4-2-3-5-9/h6H,2-5H2,1H3,(H,10,13)(H,11,12)/t6-/m0/s1

InChIKey

LTRSPDHUDXWHRY-LURJTMIESA-N

Compound name

(8S)-8-methyl-6,9-diazaspiro[4.5]decane-7,10-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 26
References: 319
Patents: 182.10553 Da
Monoisotopic Mass: 0.2
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]+	183.11281	142.4
[M+Na]+	205.09475	151.1
[M+NH4]+	200.13935	150.7
[M+K]+	221.06869	146.4
[M-H]-	181.09825	142.0
[M+Na-2H]-	203.08020	145.9
[M]+	182.10498	143.2
[M]-	182.10608	143.2

Literature stripe

literature stripe

Patent stripe

patents stripe