CID 4542027

1-(morpholin-2-yl)methanamine

Structural Information

Molecular Formula

C₅H₁₂N₂O

SMILES

C1COC(CN1)CN

InChI

InChI=1S/C5H12N2O/c6-3-5-4-7-1-2-8-5/h5,7H,1-4,6H2

InChIKey

OXYALYJRWGRVAM-UHFFFAOYSA-N

Compound name

morpholin-2-ylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 541
Patents: 116.09496 Da
Monoisotopic Mass: -1.5
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]+	117.10224	124.5
[M+Na]+	139.08418	129.2
[M-H]-	115.08768	124.7
[M+NH4]+	134.12878	142.8
[M+K]+	155.05812	128.9
[M+H-H2O]+	99.092220	118.2
[M+HCOO]-	161.09316	142.8
[M+CH3COO]-	175.10881	166.4
[M+Na-2H]-	137.06963	131.4
[M]+	116.09441	117.5
[M]-	116.09551	117.5

Literature stripe

literature stripe

Patent stripe

patents stripe