CID 4961266

676245-12-8

Structural Information

Molecular Formula

C₁₁H₁₅NO

SMILES

C1CCN(C1)C2=CC=C(C=C2)CO

InChI

InChI=1S/C11H15NO/c13-9-10-3-5-11(6-4-10)12-7-1-2-8-12/h3-6,13H,1-2,7-9H2

InChIKey

URPRBAHGHXSPKI-UHFFFAOYSA-N

Compound name

(4-pyrrolidin-1-ylphenyl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 177.11537 Da
Monoisotopic Mass: 2.7
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