CID 43521152

1351647-51-2

Structural Information

Molecular Formula

C₇H₁₂N₂O

SMILES

C1CC1N2CC(CC2=O)N

InChI

InChI=1S/C7H12N2O/c8-5-3-7(10)9(4-5)6-1-2-6/h5-6H,1-4,8H2

InChIKey

PSINJBJNAVYKLD-UHFFFAOYSA-N

Compound name

4-amino-1-cyclopropylpyrrolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 140.09496 Da
Monoisotopic Mass: -0.9
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]+	141.102236	129.6
[M+Na]+	163.084178	139.0
[M-H]-	139.087684	135.5
[M+NH4]+	158.128783	146.4
[M+K]+	179.058118	135.8
[M+H-H2O]+	123.092220	123.2
[M+HCOO]-	185.093161	152.3
[M+CH3COO]-	199.108811	178.4
[M+Na-2H]-	161.069626	132.9
[M]+	140.09441142	128.2
[M]-	140.09550858	128.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe