CID 2760161

340319-91-7

Structural Information

Molecular Formula

C₁₅H₁₃NO₃

SMILES

C1C(CN(C1=O)C2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C15H13NO3/c17-14-8-11(15(18)19)9-16(14)13-7-3-5-10-4-1-2-6-12(10)13/h1-7,11H,8-9H2,(H,18,19)

InChIKey

XARHILSRKCHUAE-UHFFFAOYSA-N

Compound name

1-naphthalen-1-yl-5-oxopyrrolidine-3-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 255.08954 Da
Monoisotopic Mass: 1.8
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]+	256.096816	155.9
[M+Na]+	278.078758	163.7
[M-H]-	254.082264	161.1
[M+NH4]+	273.123363	173.5
[M+K]+	294.052698	159.4
[M+H-H2O]+	238.086800	148.8
[M+HCOO]-	300.087741	174.8
[M+CH3COO]-	314.103391	192.3
[M+Na-2H]-	276.064206	158.2
[M]+	255.08899142	154.2
[M]-	255.09008858	154.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.