CID 327024

848580-34-7

Structural Information

Molecular Formula

C₉H₁₆N₂O

SMILES

CN1CCC2(C1=O)CCNCC2

InChI

InChI=1S/C9H16N2O/c1-11-7-4-9(8(11)12)2-5-10-6-3-9/h10H,2-7H2,1H3

InChIKey

JTWGSQNWXVCXLD-UHFFFAOYSA-N

Compound name

2-methyl-2,8-diazaspiro[4.5]decan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 213
Patents: 168.12627 Da
Monoisotopic Mass: -0.3
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]+	169.13355	140.2
[M+Na]+	191.11549	149.6
[M+NH4]+	186.16009	149.7
[M+K]+	207.08943	143.8
[M-H]-	167.11899	141.0
[M+Na-2H]-	189.10094	145.1
[M]+	168.12572	141.5
[M]-	168.12682	141.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe