CID 11116595

5-(4-hydroxyphenyl)pyrrolidin-2-one

Structural Information

Molecular Formula

C₁₀H₁₁NO₂

SMILES

C1CC(=O)NC1C2=CC=C(C=C2)O

InChI

InChI=1S/C10H11NO2/c12-8-3-1-7(2-4-8)9-5-6-10(13)11-9/h1-4,9,12H,5-6H2,(H,11,13)

InChIKey

BVEBXSJCBLQXPZ-UHFFFAOYSA-N

Compound name

5-(4-hydroxyphenyl)pyrrolidin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 55
Patents: 177.07898 Da
Monoisotopic Mass: 0.8
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]+	178.08626	138.3
[M+Na]+	200.06820	149.7
[M+NH4]+	195.11280	146.2
[M+K]+	216.04214	145.8
[M-H]-	176.07170	140.1
[M+Na-2H]-	198.05365	144.1
[M]+	177.07843	140.1
[M]-	177.07953	140.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe