CID 145867480

2375274-48-7

Structural Information

Molecular Formula

C₉H₁₆N₂O

SMILES

CC1(CN(C1=O)C2CCNC2)C

InChI

InChI=1S/C9H16N2O/c1-9(2)6-11(8(9)12)7-3-4-10-5-7/h7,10H,3-6H2,1-2H3

InChIKey

UUVXFJPOZYIGFU-UHFFFAOYSA-N

Compound name

3,3-dimethyl-1-pyrrolidin-3-ylazetidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 168.12627 Da
Monoisotopic Mass: 0.1
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	136.5
[M+Na]+	191.11549	142.6
[M-H]-	167.11899	139.1
[M+NH4]+	186.16009	151.1
[M+K]+	207.08943	143.2
[M+H-H2O]+	151.12353	126.1
[M+HCOO]-	213.12447	153.6
[M+CH3COO]-	227.14012	179.5
[M+Na-2H]-	189.10094	139.1
[M]+	168.12572	141.1
[M]-	168.12682	141.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.