CID 24262147

6-(aminomethyl)-4-methyl-3-morpholinone

Structural Information

Molecular Formula

C₆H₁₂N₂O₂

SMILES

CN1CC(OCC1=O)CN

InChI

InChI=1S/C6H12N2O2/c1-8-3-5(2-7)10-4-6(8)9/h5H,2-4,7H2,1H3

InChIKey

YFDRAVVFENWUHT-UHFFFAOYSA-N

Compound name

6-(aminomethyl)-4-methylmorpholin-3-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 8
Patents: 144.08987 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]+	145.09715	129.7
[M+Na]+	167.07909	140.0
[M+NH4]+	162.12369	137.2
[M+K]+	183.05303	135.6
[M-H]-	143.08259	132.0
[M+Na-2H]-	165.06454	133.3
[M]+	144.08932	131.5
[M]-	144.09042	131.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe