CID 62327908

1067659-46-4

Structural Information

Molecular Formula

C₁₀H₁₄N₂O

SMILES

C1CNCC1OCC2=CN=CC=C2

InChI

InChI=1S/C10H14N2O/c1-2-9(6-11-4-1)8-13-10-3-5-12-7-10/h1-2,4,6,10,12H,3,5,7-8H2

InChIKey

DUNDEYKIQYKAEQ-UHFFFAOYSA-N

Compound name

3-(pyrrolidin-3-yloxymethyl)pyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 178.11061 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]+	179.11789	138.7
[M+Na]+	201.09983	144.4
[M-H]-	177.10333	140.6
[M+NH4]+	196.14443	156.6
[M+K]+	217.07377	141.6
[M+H-H2O]+	161.10787	130.5
[M+HCOO]-	223.10881	158.4
[M+CH3COO]-	237.12446	175.4
[M+Na-2H]-	199.08528	143.8
[M]+	178.11006	134.8
[M]-	178.11116	134.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe