CID 11240830

85187-28-6

Structural Information

Molecular Formula

C₉H₁₄N₂O₂

SMILES

C1CCN(C1)C(=O)[C@@H]2CCC(=O)N2

InChI

InChI=1S/C9H14N2O2/c12-8-4-3-7(10-8)9(13)11-5-1-2-6-11/h7H,1-6H2,(H,10,12)/t7-/m0/s1

InChIKey

IWMYEQSITOXBMZ-ZETCQYMHSA-N

Compound name

(5S)-5-(pyrrolidine-1-carbonyl)pyrrolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 182.10553 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]+	183.112806	142.6
[M+Na]+	205.094748	147.7
[M-H]-	181.098254	144.6
[M+NH4]+	200.139353	162.0
[M+K]+	221.068688	145.9
[M+H-H2O]+	165.102790	135.3
[M+HCOO]-	227.103731	160.0
[M+CH3COO]-	241.119381	175.3
[M+Na-2H]-	203.080196	141.6
[M]+	182.10498142	136.0
[M]-	182.10607858	136.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe