CID 12937991

3-(3-methoxyphenyl)pyrrolidine hydrochloride

Structural Information

Molecular Formula

C₁₁H₁₅NO

SMILES

COC1=CC=CC(=C1)C2CCNC2

InChI

InChI=1S/C11H15NO/c1-13-11-4-2-3-9(7-11)10-5-6-12-8-10/h2-4,7,10,12H,5-6,8H2,1H3

InChIKey

MDZWFRVPKYMLPL-UHFFFAOYSA-N

Compound name

3-(3-methoxyphenyl)pyrrolidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 65
Patents: 177.11537 Da
Monoisotopic Mass: 1.6
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]+	178.12265	140.1
[M+Na]+	200.10459	152.0
[M+NH4]+	195.14919	149.1
[M+K]+	216.07853	146.8
[M-H]-	176.10809	143.2
[M+Na-2H]-	198.09004	147.1
[M]+	177.11482	142.5
[M]-	177.11592	142.5

Literature stripe

literature stripe

Patent stripe

patents stripe